2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide

C18H21NO3 — CID 72846372

IUPAC2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide
SMILESCOc1cc(OC)cc(-c2ccccc2C(=O)NC(C)C)c1
InChIInChI=1S/C18H21NO3/c1-12(2)19-18(20)17-8-6-5-7-16(17)13-9-14(21-3)11-15(10-13)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyIYUGXFOHGQRGKX-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.51
Rot. Bonds5

About 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide

2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide (PubChem CID 72846372) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide
PubChem CID72846372
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide
SMILESCOc1cc(OC)cc(-c2ccccc2C(=O)NC(C)C)c1
InChIInChI=1S/C18H21NO3/c1-12(2)19-18(20)17-8-6-5-7-16(17)13-9-14(21-3)11-15(10-13)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyIYUGXFOHGQRGKX-UHFFFAOYSA-N
XLogP3.51
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide 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-methoxyphenyl)ethyl]-2-phenylbenzamide
CID 154835213
2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propan-2-ylbenzamide
CID 3267440
N,2-di(propan-2-yl)benzamide
CID 14972595
2-amino-4-methoxy-N-propan-2-ylbenzamide
CID 14274445
N-propan-2-yl-2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]benzamide
CID 3159481
ethane;2-methyl-N-propan-2-ylbenzamide
CID 164554205
N-(3,5-dimethoxyphenyl)-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzamide
CID 9096637
2-(5-chloro-4-hydroxy-2-methylphenyl)-N-propan-2-ylbenzamide
CID 137343462
N-butan-2-yl-2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]benzamide
CID 133150062
3-(3,5-dimethoxyphenyl)-2-ethylbenzamide
CID 68986880
2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
CID 4149029
methyl 3-oxo-3-[2-(propan-2-ylcarbamoyl)anilino]propanoate
CID 28638001

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide?
The IUPAC name of 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide (CID 72846372) is 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide?
The canonical SMILES for 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide is COc1cc(OC)cc(-c2ccccc2C(=O)NC(C)C)c1.
What is the InChIKey of 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide?
The InChIKey is IYUGXFOHGQRGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-12(2)19-18(20)17-8-6-5-7-16(17)13-9-14(21-3)11-15(10-13)22-4/h5-12H,1-4H3,(H,19,20).
What are the key properties of 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide?
2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide has a molecular weight of 299.37 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide is sourced from PubChem (CID 72846372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).