3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide

C12H12ClN3O2S — CID 103303099

IUPAC3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2ncccc2N)cc1Cl
InChIInChI=1S/C12H12ClN3O2S/c1-8-4-5-9(7-10(8)13)16-19(17,18)12-11(14)3-2-6-15-12/h2-7,16H,14H2,1H3
InChIKeyUVMBUOUEDODCQK-UHFFFAOYSA-N
MW297.77 g/mol
LogP2.43
Rot. Bonds3

About 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide

3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide (PubChem CID 103303099) has the molecular formula C12H12ClN3O2S and a molecular weight of 297.77 g/mol. Its IUPAC name is 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide
PubChem CID103303099
Molecular FormulaC12H12ClN3O2S
Molecular Weight297.77 g/mol
Exact Mass297.03
IUPAC Name3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2ncccc2N)cc1Cl
InChIInChI=1S/C12H12ClN3O2S/c1-8-4-5-9(7-10(8)13)16-19(17,18)12-11(14)3-2-6-15-12/h2-7,16H,14H2,1H3
InChIKeyUVMBUOUEDODCQK-UHFFFAOYSA-N
XLogP2.43
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.77
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-Methyl-N-pyridin-3-YL-benzenesulfonamide
CID 757406
N-(2-chloro-5-phenyl-3-pyridinyl)benzenesulfonamide
CID 25266674
Benzenesulfonamide, 2,4-dichloro-3-methyl-N-(3-pyridyl)-
CID 534146
6-chloro-N-(2,4-dimethylphenyl)pyridine-3-sulfonamide
CID 4729873
N-(2-chloro-5-pyridin-3-yl-3-pyridinyl)benzenesulfonamide
CID 87570551
N-benzyl-6-chloro-N-methyl-3-pyridinesulfonamide
CID 830476
4-chloro-N-3-pyridinyl-3-(trifluoromethyl)benzenesulfonamide
CID 889815
4-chloro-N-[2-(dimethylamino)-2-pyridin-3-ylethyl]benzenesulfonamide
CID 5043635
N-(2-chloro-5-pyridin-4-yl-3-pyridinyl)methanesulfonamide
CID 155537016
N-(2-chloro-5-pyridin-4-yl-3-pyridinyl)benzenesulfonamide
CID 87570433
Biphenyl-4-sulfonic acid (2-chloro-pyridin-3-yl)-amide
CID 1087769
N-(2-chloro-3-pyridinyl)-4-fluorobenzenesulfonamide
CID 2169091

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide (CID 103303099) is 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide is Cc1ccc(NS(=O)(=O)c2ncccc2N)cc1Cl.
What is the InChIKey of 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide?
The InChIKey is UVMBUOUEDODCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O2S/c1-8-4-5-9(7-10(8)13)16-19(17,18)12-11(14)3-2-6-15-12/h2-7,16H,14H2,1H3.
What are the key properties of 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide?
3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide has a molecular weight of 297.77 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-chloro-4-methylphenyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103303099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).