2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide

C18H22N2O5S — CID 5034274

IUPAC2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cccc(C)c2)cc1OC
InChIInChI=1S/C18H22N2O5S/c1-12-6-5-7-14(10-12)19-18(21)13(2)20-26(22,23)15-8-9-16(24-3)17(11-15)25-4/h5-11,13,20H,1-4H3,(H,19,21)
InChIKeyPDVFMXVOUPDREX-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.32
Rot. Bonds7

About 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide

2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide (PubChem CID 5034274) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide
PubChem CID5034274
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC Name2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cccc(C)c2)cc1OC
InChIInChI=1S/C18H22N2O5S/c1-12-6-5-7-14(10-12)19-18(21)13(2)20-26(22,23)15-8-9-16(24-3)17(11-15)25-4/h5-11,13,20H,1-4H3,(H,19,21)
InChIKeyPDVFMXVOUPDREX-UHFFFAOYSA-N
XLogP2.32
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide 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

2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 5253893
(2S)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylsulfanylphenyl)propanamide
CID 126394180
(2S)-N-(3,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41302643
(2S)-2-(benzenesulfonamido)-N-(3,4-dimethoxyphenyl)propanamide
CID 51432486
N-(3,4-dimethoxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 3918637
(2R)-N-[3,5-bis(trifluoromethyl)phenyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 28549200
(2R)-N-(2,5-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339684
(2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(4-ethoxyphenyl)propanamide
CID 126397145
(2R)-2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)-3-phenylpropanamide
CID 28541662
(2R)-N-(2,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339682
(2R)-N-cyclopropyl-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 7369499
(2R)-2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]propanamide
CID 124548042

Frequently Asked Questions

What is the IUPAC name of 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide?
The IUPAC name of 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide (CID 5034274) is 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide.
What is the SMILES notation for 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide?
The canonical SMILES for 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide is COc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cccc(C)c2)cc1OC.
What is the InChIKey of 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide?
The InChIKey is PDVFMXVOUPDREX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-12-6-5-7-14(10-12)19-18(21)13(2)20-26(22,23)15-8-9-16(24-3)17(11-15)25-4/h5-11,13,20H,1-4H3,(H,19,21).
What are the key properties of 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide?
2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide has a molecular weight of 378.45 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 5034274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).