5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide

C20H18BrN3O4S — CID 20959993

IUPAC5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cncc(NS(=O)(=O)c2ccc(Br)cc2)c1
InChIInChI=1S/C20H18BrN3O4S/c1-2-28-19-6-4-3-5-18(19)23-20(25)14-11-16(13-22-12-14)24-29(26,27)17-9-7-15(21)8-10-17/h3-13,24H,2H2,1H3,(H,23,25)
InChIKeyCGLPEQLDEYWDRC-UHFFFAOYSA-N
MW476.35 g/mol
LogP4.30
Rot. Bonds7

About 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide

5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide (PubChem CID 20959993) has the molecular formula C20H18BrN3O4S and a molecular weight of 476.35 g/mol. Its IUPAC name is 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide
PubChem CID20959993
Molecular FormulaC20H18BrN3O4S
Molecular Weight476.35 g/mol
Exact Mass475.02
IUPAC Name5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cncc(NS(=O)(=O)c2ccc(Br)cc2)c1
InChIInChI=1S/C20H18BrN3O4S/c1-2-28-19-6-4-3-5-18(19)23-20(25)14-11-16(13-22-12-14)24-29(26,27)17-9-7-15(21)8-10-17/h3-13,24H,2H2,1H3,(H,23,25)
InChIKeyCGLPEQLDEYWDRC-UHFFFAOYSA-N
XLogP4.30
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.35
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,5-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109243078
3-N-(2-ethoxyphenyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101457
5-(benzylamino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109231887
5-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 20960000
5-(4-tert-butylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109244073
5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
5-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109242967
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109245387
N-(2-tert-butylphenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109244010
N-(2-ethoxyphenyl)-5-(2-ethyl-6-methylanilino)pyridine-3-carboxamide
CID 109243714
5-N-(2-ethoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108895
N-(2,3-dimethylphenyl)-5-[(4-methylphenyl)sulfonylamino]pyridine-3-carboxamide
CID 7161193

Frequently Asked Questions

What is the IUPAC name of 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide (CID 20959993) is 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide is CCOc1ccccc1NC(=O)c1cncc(NS(=O)(=O)c2ccc(Br)cc2)c1.
What is the InChIKey of 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is CGLPEQLDEYWDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18BrN3O4S/c1-2-28-19-6-4-3-5-18(19)23-20(25)14-11-16(13-22-12-14)24-29(26,27)17-9-7-15(21)8-10-17/h3-13,24H,2H2,1H3,(H,23,25).
What are the key properties of 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 476.35 g/mol, XLogP of 4.30, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-bromophenyl)sulfonylamino]-N-(2-ethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 20959993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).