3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide

C14H23N3O2S — CID 103305012

IUPAC3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)NCC1CCCCC1C
InChIInChI=1S/C14H23N3O2S/c1-11-6-3-4-7-12(11)10-17-20(18,19)14-13(15-2)8-5-9-16-14/h5,8-9,11-12,15,17H,3-4,6-7,10H2,1-2H3
InChIKeyFYVXQXDBORUWCW-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.23
Rot. Bonds5

About 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide

3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide (PubChem CID 103305012) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide
PubChem CID103305012
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)NCC1CCCCC1C
InChIInChI=1S/C14H23N3O2S/c1-11-6-3-4-7-12(11)10-17-20(18,19)14-13(15-2)8-5-9-16-14/h5,8-9,11-12,15,17H,3-4,6-7,10H2,1-2H3
InChIKeyFYVXQXDBORUWCW-UHFFFAOYSA-N
XLogP2.23
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide
CID 103301265
2-amino-N-[(2-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 62147960
N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306367
N-cyclobutyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305744
N-(2-hydroxycyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305739
N-(3-ethyl-2-methylcyclopentyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306293
3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
2-(methylamino)-N-[(2-methylcyclopentyl)methyl]pyrimidine-5-sulfonamide
CID 107420494
N-[(2-methylcyclohexyl)methyl]-1H-pyrazole-5-sulfonamide
CID 102692871
N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300867
2-(ethylamino)-N-[(2-methylcyclopentyl)methyl]benzenesulfonamide
CID 107420501
N-(3,5-dimethylcyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306280

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide?
The IUPAC name of 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide (CID 103305012) is 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)NCC1CCCCC1C.
What is the InChIKey of 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide?
The InChIKey is FYVXQXDBORUWCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-11-6-3-4-7-12(11)10-17-20(18,19)14-13(15-2)8-5-9-16-14/h5,8-9,11-12,15,17H,3-4,6-7,10H2,1-2H3.
What are the key properties of 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide?
3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide is sourced from PubChem (CID 103305012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).