cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid

C12H13N3O4S — CID 106321509

IUPACcis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid
SMILESN#Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cn1
InChIInChI=1S/C12H13N3O4S/c13-6-10-3-4-11(7-14-10)20(18,19)15-9-2-1-8(5-9)12(16)17/h3-4,7-9,15H,1-2,5H2,(H,16,17)/t8-,9+/m1/s1
InChIKeySFTNJONMVQCXLQ-BDAKNGLRSA-N
MW295.32 g/mol
LogP0.48
Rot. Bonds4

About cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid

cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid (PubChem CID 106321509) has the molecular formula C12H13N3O4S and a molecular weight of 295.32 g/mol. Its IUPAC name is cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid
PubChem CID106321509
Molecular FormulaC12H13N3O4S
Molecular Weight295.32 g/mol
Exact Mass295.06
IUPAC Namecis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid
SMILESN#Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cn1
InChIInChI=1S/C12H13N3O4S/c13-6-10-3-4-11(7-14-10)20(18,19)15-9-2-1-8(5-9)12(16)17/h3-4,7-9,15H,1-2,5H2,(H,16,17)/t8-,9+/m1/s1
InChIKeySFTNJONMVQCXLQ-BDAKNGLRSA-N
XLogP0.48
TPSA120.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.32
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-cyano-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
CID 103653105
6-cyano-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 115602590
6-cyano-N-cyclooctylpyridine-3-sulfonamide
CID 115602393
6-cyano-N-(1,2-dimethylpiperidin-4-yl)pyridine-3-sulfonamide
CID 115650598
6-cyano-N-(oxolan-3-yl)pyridine-3-sulfonamide
CID 113320215
6-cyano-N-(thiolan-3-yl)pyridine-3-sulfonamide
CID 103698000
cis-(1R,3S)-3-[(3-cyanophenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 106321518
3-[(4-iodophenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 66030163
3-[(4-nitrophenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 66032166
6-cyano-N-(2-hydroxycycloheptyl)pyridine-3-sulfonamide
CID 114613918
6-cyano-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
CID 114613875
3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid (CID 106321509) is cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid is N#Cc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cn1.
What is the InChIKey of cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid?
The InChIKey is SFTNJONMVQCXLQ-BDAKNGLRSA-N. The full InChI is InChI=1S/C12H13N3O4S/c13-6-10-3-4-11(7-14-10)20(18,19)15-9-2-1-8(5-9)12(16)17/h3-4,7-9,15H,1-2,5H2,(H,16,17)/t8-,9+/m1/s1.
What are the key properties of cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid?
cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid has a molecular weight of 295.32 g/mol, XLogP of 0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 106321509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).