6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide

C22H17ClN2O3S — CID 142036672

IUPAC6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1Oc1ccc2ccccc2c1
InChIInChI=1S/C22H17ClN2O3S/c1-15-12-18(25-29(26,27)20-9-11-22(23)24-14-20)7-10-21(15)28-19-8-6-16-4-2-3-5-17(16)13-19/h2-14,25H,1H3
InChIKeyUCMQHMGTRMGUBL-UHFFFAOYSA-N
MW424.91 g/mol
LogP5.79
Rot. Bonds5

About 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide

6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide (PubChem CID 142036672) has the molecular formula C22H17ClN2O3S and a molecular weight of 424.91 g/mol. Its IUPAC name is 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide
PubChem CID142036672
Molecular FormulaC22H17ClN2O3S
Molecular Weight424.91 g/mol
Exact Mass424.06
IUPAC Name6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1Oc1ccc2ccccc2c1
InChIInChI=1S/C22H17ClN2O3S/c1-15-12-18(25-29(26,27)20-9-11-22(23)24-14-20)7-10-21(15)28-19-8-6-16-4-2-3-5-17(16)13-19/h2-14,25H,1H3
InChIKeyUCMQHMGTRMGUBL-UHFFFAOYSA-N
XLogP5.79
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.91
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-(3,4-dimethylphenyl)pyridine-3-sulfonamide
CID 4729839
6-chloro-N-(3-chloro-4-naphthalen-2-ylsulfonylphenyl)pyridine-3-sulfonamide
CID 23515225
6-chloro-N-(3-iodo-4-methylphenyl)pyridine-3-sulfonamide
CID 26950537
6-chloro-N-phenylpyridine-3-sulfonamide
CID 4729892
6-chloro-N-(4-ethoxy-3-fluorophenyl)pyridine-3-sulfonamide
CID 115588666
6-chloro-N-(4-phenylmethoxyphenyl)pyridine-3-sulfonamide
CID 26951357
6-chloro-N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyridine-3-sulfonamide
CID 4875200
4-chloro-N-(3-chloro-4-quinolin-6-yloxyphenyl)benzenesulfonamide
CID 67931068
4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
CID 7938656
N-(3-chloro-4-naphthalen-2-ylsulfinylphenyl)-6-methylpyridine-3-sulfonamide
CID 143108287
methyl 5-[(6-chloro-3-pyridinyl)sulfamoyl]-2-methylbenzoate
CID 87814534
4-chloro-N-[4-(6-methylquinolin-8-yl)oxyphenyl]benzenesulfonamide
CID 19769793

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide (CID 142036672) is 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide is Cc1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1Oc1ccc2ccccc2c1.
What is the InChIKey of 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide?
The InChIKey is UCMQHMGTRMGUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN2O3S/c1-15-12-18(25-29(26,27)20-9-11-22(23)24-14-20)7-10-21(15)28-19-8-6-16-4-2-3-5-17(16)13-19/h2-14,25H,1H3.
What are the key properties of 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide?
6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide has a molecular weight of 424.91 g/mol, XLogP of 5.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-methyl-4-naphthalen-2-yloxyphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 142036672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).