3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide

C20H19N3O3S — CID 17361430

IUPAC3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1CCC(=O)Nc1cccc(C(=O)Nc2nccs2)c1
InChIInChI=1S/C20H19N3O3S/c1-26-17-8-3-2-5-14(17)9-10-18(24)22-16-7-4-6-15(13-16)19(25)23-20-21-11-12-27-20/h2-8,11-13H,9-10H2,1H3,(H,22,24)(H,21,23,25)
InChIKeyOWFDFWFJUMHBDQ-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.98
Rot. Bonds7

About 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide

3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 17361430) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
PubChem CID17361430
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC Name3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1CCC(=O)Nc1cccc(C(=O)Nc2nccs2)c1
InChIInChI=1S/C20H19N3O3S/c1-26-17-8-3-2-5-14(17)9-10-18(24)22-16-7-4-6-15(13-16)19(25)23-20-21-11-12-27-20/h2-8,11-13H,9-10H2,1H3,(H,22,24)(H,21,23,25)
InChIKeyOWFDFWFJUMHBDQ-UHFFFAOYSA-N
XLogP3.98
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide 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

N-(1,3-thiazol-2-yl)-3-[[2-(2,4,5-trimethylphenoxy)acetyl]amino]benzamide
CID 17296385
2-ethoxy-N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 9321520
ethyl 3-[3-(2-methoxyphenyl)propanoylamino]benzoate
CID 9228232
3-(2-ethylbutanoylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 977043
3-[[(2R)-2-methylbutanoyl]amino]-N-(1,3-thiazol-2-yl)benzamide
CID 27262078
3,4-dimethyl-N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 9321514
3-(2-methoxyphenyl)-N-phenylpropanamide
CID 7732837
N-(3-ethylphenyl)-3-(2-methoxyphenyl)propanamide
CID 7699788
3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361308
N-(3-acetylphenyl)-2-[2-(2-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109172828
N-[(2-methoxyphenyl)methyl]-N'-(1,3-thiazol-2-yl)oxamide
CID 2926552
3-[[2-[4-[(2S)-butan-2-yl]phenoxy]acetyl]amino]-N-(1,3-thiazol-2-yl)benzamide
CID 1116727

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide (CID 17361430) is 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide is COc1ccccc1CCC(=O)Nc1cccc(C(=O)Nc2nccs2)c1.
What is the InChIKey of 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is OWFDFWFJUMHBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-26-17-8-3-2-5-14(17)9-10-18(24)22-16-7-4-6-15(13-16)19(25)23-20-21-11-12-27-20/h2-8,11-13H,9-10H2,1H3,(H,22,24)(H,21,23,25).
What are the key properties of 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide?
3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 381.46 g/mol, XLogP of 3.98, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methoxyphenyl)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 17361430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).