2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide

C16H18N2O4S — CID 2980013

IUPAC2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c1-12(16(19)17-13-6-4-3-5-7-13)18-23(20,21)15-10-8-14(22-2)9-11-15/h3-12,18H,1-2H3,(H,17,19)
InChIKeyVEFJQRMNSOKTQL-UHFFFAOYSA-N
MW334.40 g/mol
LogP2.00
Rot. Bonds6

About 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide

2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide (PubChem CID 2980013) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide
PubChem CID2980013
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC Name2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c1-12(16(19)17-13-6-4-3-5-7-13)18-23(20,21)15-10-8-14(22-2)9-11-15/h3-12,18H,1-2H3,(H,17,19)
InChIKeyVEFJQRMNSOKTQL-UHFFFAOYSA-N
XLogP2.00
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzenesulfonamido)-N-(4-methoxyphenyl)propanamide
CID 3923761
(2S)-N-(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 40534613
(1-anilino-1-oxopropan-2-yl) (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate
CID 55928591
(2S)-2-(benzenesulfonamido)-N-phenylpropanamide
CID 41330853
(2R)-N-(4-fluorophenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 124548460
2-[(4-methylphenyl)sulfonylamino]-N-phenylpropanamide
CID 5205930
(2R)-2-(naphthalen-2-ylsulfonylamino)-N-phenylpropanamide
CID 7393168
(2R)-2-[(4-bromophenyl)sulfonylamino]-N-phenylpropanamide
CID 1296182
2-[(4-chlorophenyl)sulfonylamino]-N-phenylpropanamide
CID 50740302
N-(3,4-dimethoxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 3918637
N-(1-hydrazinyl-1-oxopropan-2-yl)-4-methoxybenzenesulfonamide
CID 3351082
(2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-(2-phenylethyl)propanamide
CID 40640573

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide?
The IUPAC name of 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide (CID 2980013) is 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide.
What is the SMILES notation for 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide?
The canonical SMILES for 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide is COc1ccc(S(=O)(=O)NC(C)C(=O)Nc2ccccc2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide?
The InChIKey is VEFJQRMNSOKTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c1-12(16(19)17-13-6-4-3-5-7-13)18-23(20,21)15-10-8-14(22-2)9-11-15/h3-12,18H,1-2H3,(H,17,19).
What are the key properties of 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide?
2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide has a molecular weight of 334.40 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)sulfonylamino]-N-phenylpropanamide is sourced from PubChem (CID 2980013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).