2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide

C12H19N3O2S — CID 107411108

IUPAC2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
SMILESCC1CCC(CNS(=O)(=O)c2cccnc2N)C1
InChIInChI=1S/C12H19N3O2S/c1-9-4-5-10(7-9)8-15-18(16,17)11-3-2-6-14-12(11)13/h2-3,6,9-10,15H,4-5,7-8H2,1H3,(H2,13,14)
InChIKeyCOFMTSUGNBEUOF-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.38
Rot. Bonds4

About 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide

2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide (PubChem CID 107411108) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
PubChem CID107411108
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
SMILESCC1CCC(CNS(=O)(=O)c2cccnc2N)C1
InChIInChI=1S/C12H19N3O2S/c1-9-4-5-10(7-9)8-15-18(16,17)11-3-2-6-14-12(11)13/h2-3,6,9-10,15H,4-5,7-8H2,1H3,(H2,13,14)
InChIKeyCOFMTSUGNBEUOF-UHFFFAOYSA-N
XLogP1.38
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107412513
2-hydrazinyl-N-[(3-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 114130685
2-amino-N-[(2-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 62147960
2-amino-N-(oxolan-3-ylmethyl)pyridine-3-sulfonamide
CID 62825249
2-amino-N-[(3-methylcyclohexyl)methyl]benzenesulfonamide
CID 104859207
6-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107411147
5-amino-3-methyl-N-[(3-methylcyclopentyl)methyl]imidazole-4-sulfonamide
CID 107411072
2-amino-6-methyl-N-[(3-methylcyclopentyl)methyl]benzenesulfonamide
CID 107411164
N-[(3-methylcyclopentyl)methyl]-1H-pyrazole-5-sulfonamide
CID 107414868
3-amino-4-methyl-N-[(3-methylcyclopentyl)methyl]benzenesulfonamide
CID 107411115
2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 63316665
N-[2-[(2-amino-3-pyridinyl)sulfonylamino]ethyl]acetamide
CID 62146437

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide (CID 107411108) is 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide is CC1CCC(CNS(=O)(=O)c2cccnc2N)C1.
What is the InChIKey of 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The InChIKey is COFMTSUGNBEUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-9-4-5-10(7-9)8-15-18(16,17)11-3-2-6-14-12(11)13/h2-3,6,9-10,15H,4-5,7-8H2,1H3,(H2,13,14).
What are the key properties of 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(3-methylcyclopentyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 107411108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).