Z9I

1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine

Created:	2023-06-23
Last modified:	2023-07-12

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2 entries where Z9I is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	1
Bond Count	25
Aromatic Bond Count	0

2D diagram of Z9I

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Chemical Component Summary
Name	1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine
Systematic Name (OpenEye OEToolkits)	[(2~{R})-1-methylsulfonylpyrrolidin-2-yl]methanamine
Formula	C₆ H₁₄ N₂ O₂ S
Molecular Weight	178.253
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	NCC1CCCN1S(=O)(C)=O
SMILES	CACTVS	3.385	C[S](=O)(=O)N1CCC[CH]1CN
SMILES	OpenEye OEToolkits	2.0.7	CS(=O)(=O)N1CCCC1CN
Canonical SMILES	CACTVS	3.385	C[S](=O)(=O)N1CCC[C@@H]1CN
Canonical SMILES	OpenEye OEToolkits	2.0.7	CS(=O)(=O)N1CCC[C@@H]1CN
InChI	InChI	1.06	InChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1
InChIKey	InChI	1.06	RYZYXPKYSJEBDD-ZCFIWIBFSA-N

Related Resource References

Resource Name	Reference
PubChem	71757008

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