6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide

C18H17ClN4O2S — CID 146199328

IUPAC6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide
SMILESCc1ccc(-c2nc(NS(=O)(=O)c3cccc(N)n3)ccc2Cl)c(C)c1
InChIInChI=1S/C18H17ClN4O2S/c1-11-6-7-13(12(2)10-11)18-14(19)8-9-16(22-18)23-26(24,25)17-5-3-4-15(20)21-17/h3-10H,1-2H3,(H2,20,21)(H,22,23)
InChIKeyGSGOIOZUBFITSW-UHFFFAOYSA-N
MW388.88 g/mol
LogP3.80
Rot. Bonds4

About 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide

6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide (PubChem CID 146199328) has the molecular formula C18H17ClN4O2S and a molecular weight of 388.88 g/mol. Its IUPAC name is 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide
PubChem CID146199328
Molecular FormulaC18H17ClN4O2S
Molecular Weight388.88 g/mol
Exact Mass388.08
IUPAC Name6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide
SMILESCc1ccc(-c2nc(NS(=O)(=O)c3cccc(N)n3)ccc2Cl)c(C)c1
InChIInChI=1S/C18H17ClN4O2S/c1-11-6-7-13(12(2)10-11)18-14(19)8-9-16(22-18)23-26(24,25)17-5-3-4-15(20)21-17/h3-10H,1-2H3,(H2,20,21)(H,22,23)
InChIKeyGSGOIOZUBFITSW-UHFFFAOYSA-N
XLogP3.80
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.88
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-[5-chloro-6-(2-cyclopropylphenyl)-2-pyridinyl]pyridine-2-sulfonamide
CID 134306401
6-amino-N-[5-chloro-6-[2-chloro-6-(trifluoromethyl)phenyl]-2-pyridinyl]pyridine-2-sulfonamide
CID 134306511
2-amino-N-[5-chloro-6-(4-cyano-2-methylphenyl)-2-pyridinyl]pyridine-4-sulfonamide
CID 134306540
(3R)-1-[6-[[5-chloro-6-(2-methylphenyl)-2-pyridinyl]sulfamoyl]-2-pyridinyl]-3-methylpiperidine-3-carboxylic acid
CID 134328854
N-[5-chloro-6-(2-methylphenyl)-2-pyridinyl]-6-piperazin-1-ylpyridine-2-sulfonamide;hydrochloride
CID 134306979
4-[6-[[5-chloro-6-(2,6-dimethylphenyl)-2-pyridinyl]sulfamoyl]-2-pyridinyl]-3-oxopiperazine-1-carboxylic acid
CID 166706661
2-[[6-[[5-chloro-6-(2-methylphenyl)-2-pyridinyl]sulfamoyl]-2-pyridinyl]amino]cyclohexane-1-carboxylic acid
CID 175167378
N-[5-chloro-6-(2,6-dimethylphenyl)-2-pyridinyl]-6-(4-ethyl-4-methylpiperidin-1-yl)pyridine-2-sulfonamide
CID 134344518
4-amino-1-[6-[[5-chloro-6-(2,6-dimethylphenyl)-2-pyridinyl]sulfamoyl]-2-pyridinyl]piperidine-4-carboxylic acid
CID 134306514
1-[6-[[5-chloro-6-(2-phenylphenyl)-2-pyridinyl]sulfamoyl]-2-pyridinyl]-3-methylpiperidine-3-carboxylic acid
CID 155046808
N-[5-chloro-6-(2,6-dimethylphenyl)-2-pyridinyl]-6-(3-oxopiperazin-1-yl)pyridine-2-sulfonamide
CID 134306410
6-amino-N-[6-(2-cyclopropylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide
CID 134344472

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide?
The IUPAC name of 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide (CID 146199328) is 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide.
What is the SMILES notation for 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide?
The canonical SMILES for 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide is Cc1ccc(-c2nc(NS(=O)(=O)c3cccc(N)n3)ccc2Cl)c(C)c1.
What is the InChIKey of 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide?
The InChIKey is GSGOIOZUBFITSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O2S/c1-11-6-7-13(12(2)10-11)18-14(19)8-9-16(22-18)23-26(24,25)17-5-3-4-15(20)21-17/h3-10H,1-2H3,(H2,20,21)(H,22,23).
What are the key properties of 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide?
6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide has a molecular weight of 388.88 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[5-chloro-6-(2,4-dimethylphenyl)-2-pyridinyl]pyridine-2-sulfonamide is sourced from PubChem (CID 146199328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).