5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide

C12H19N3O2S — CID 114552024

IUPAC5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccc(CN)cn2)C1
InChIInChI=1S/C12H19N3O2S/c1-9-2-4-11(6-9)15-18(16,17)12-5-3-10(7-13)8-14-12/h3,5,8-9,11,15H,2,4,6-7,13H2,1H3
InChIKeyVQQDGLRZBZBLHS-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.01
Rot. Bonds4

About 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide

5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide (PubChem CID 114552024) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
PubChem CID114552024
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccc(CN)cn2)C1
InChIInChI=1S/C12H19N3O2S/c1-9-2-4-11(6-9)15-18(16,17)12-5-3-10(7-13)8-14-12/h3,5,8-9,11,15H,2,4,6-7,13H2,1H3
InChIKeyVQQDGLRZBZBLHS-UHFFFAOYSA-N
XLogP1.01
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 ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
CID 114551682
5-(aminomethyl)-N-(2-ethylcyclohexyl)pyridine-2-sulfonamide
CID 106002921
5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
CID 106064004
4-(aminomethyl)-N-(4-methylcyclohexyl)benzenesulfonamide
CID 16787126
4-(3-aminopropyl)-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114552052
N-cyclooctyl-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106058846
4-(aminomethyl)-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
CID 114138567
5-(aminomethyl)-2-bromo-N-(3-methylcyclohexyl)benzenesulfonamide
CID 106027504
5-(hydroxymethyl)-N-(4-methylsulfanylcyclohexyl)pyridine-2-sulfonamide
CID 106000954
1-[4-(aminomethyl)phenyl]-N-(4-methylcyclohexyl)methanesulfonamide
CID 29041609
5-(aminomethyl)-N-(thiolan-2-ylmethyl)pyridine-2-sulfonamide
CID 114141679
5-(propylaminomethyl)-N-(thian-4-yl)pyridine-2-sulfonamide
CID 106084462

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide (CID 114552024) is 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide is CC1CCC(NS(=O)(=O)c2ccc(CN)cn2)C1.
What is the InChIKey of 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The InChIKey is VQQDGLRZBZBLHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-9-2-4-11(6-9)15-18(16,17)12-5-3-10(7-13)8-14-12/h3,5,8-9,11,15H,2,4,6-7,13H2,1H3.
What are the key properties of 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide is sourced from PubChem (CID 114552024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).