(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide

C16H17ClN2O4S — CID 9042158

IUPAC(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C16H17ClN2O4S/c1-11(16(20)18-13-6-8-14(23-2)9-7-13)19-24(21,22)15-5-3-4-12(17)10-15/h3-11,19H,1-2H3,(H,18,20)/t11-/m0/s1
InChIKeySNSIDQNXMORMJW-NSHDSACASA-N
MW368.84 g/mol
LogP2.65
Rot. Bonds6

About (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide

(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide (PubChem CID 9042158) has the molecular formula C16H17ClN2O4S and a molecular weight of 368.84 g/mol. Its IUPAC name is (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
PubChem CID9042158
Molecular FormulaC16H17ClN2O4S
Molecular Weight368.84 g/mol
Exact Mass368.06
IUPAC Name(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C16H17ClN2O4S/c1-11(16(20)18-13-6-8-14(23-2)9-7-13)19-24(21,22)15-5-3-4-12(17)10-15/h3-11,19H,1-2H3,(H,18,20)/t11-/m0/s1
InChIKeySNSIDQNXMORMJW-NSHDSACASA-N
XLogP2.65
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.84
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzenesulfonamido)-N-(4-methoxyphenyl)propanamide
CID 3923761
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 126394209
2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide
CID 2980013
(2S)-N-(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 40534613
(2R)-N-(4-fluorophenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 124548460
(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide
CID 9319554
N-(3,4-dimethoxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 3918637
2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 1486366
(2S)-N-(3-chloro-2-methylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 2224879
N-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide
CID 112768427
(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-[(1R)-2-methyl-1-phenylpropyl]propanamide
CID 51886343
(2S)-N-(3,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41302643

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The IUPAC name of (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide (CID 9042158) is (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide is COc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2cccc(Cl)c2)cc1.
What is the InChIKey of (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The InChIKey is SNSIDQNXMORMJW-NSHDSACASA-N. The full InChI is InChI=1S/C16H17ClN2O4S/c1-11(16(20)18-13-6-8-14(23-2)9-7-13)19-24(21,22)15-5-3-4-12(17)10-15/h3-11,19H,1-2H3,(H,18,20)/t11-/m0/s1.
What are the key properties of (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide has a molecular weight of 368.84 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 9042158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).