3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide

C17H19N3O2 — CID 138046134

IUPAC3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide
SMILESCCc1cccc(N(C)C(=O)Nc2cccc(C(N)=O)c2)c1
InChIInChI=1S/C17H19N3O2/c1-3-12-6-4-9-15(10-12)20(2)17(22)19-14-8-5-7-13(11-14)16(18)21/h4-11H,3H2,1-2H3,(H2,18,21)(H,19,22)
InChIKeyGRZFGIAVPJKSIB-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.02
Rot. Bonds4

About 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide

3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide (PubChem CID 138046134) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide.

Molecular Properties

Compound Name3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide
PubChem CID138046134
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide
SMILESCCc1cccc(N(C)C(=O)Nc2cccc(C(N)=O)c2)c1
InChIInChI=1S/C17H19N3O2/c1-3-12-6-4-9-15(10-12)20(2)17(22)19-14-8-5-7-13(11-14)16(18)21/h4-11H,3H2,1-2H3,(H2,18,21)(H,19,22)
InChIKeyGRZFGIAVPJKSIB-UHFFFAOYSA-N
XLogP3.02
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]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-(3-ethylphenyl)-N-methylbenzamide
CID 90124245
2-[carboxymethyl-[(3-ethylphenyl)carbamoyl]amino]acetic acid
CID 63645936
3-(4-ethylphenyl)-1-methyl-1-phenylurea
CID 108991136
3-(3-ethylphenyl)-1-(2-hydroxyethyl)-1-methylurea
CID 111431118
3-[(3-carbamoylphenyl)carbamoyl-ethylamino]-2-methylpropanoic acid
CID 107809460
1-butyl-3-(3-ethylphenyl)-1-methylurea
CID 5202320
3-[[2-[4-[acetyl(methyl)amino]anilino]acetyl]amino]benzamide
CID 54811372
3-(methylamino)benzamide
CID 18727714
1-N,3-N,5-N-tris(3-ethylphenyl)benzene-1,3,5-tricarboxamide
CID 67992311
3-amino-N-(3-ethylphenyl)-3-sulfanylidenepropanamide
CID 28942511
1-(3-ethylphenyl)-1-methylguanidine
CID 19009787
ethane;N-(3-ethylphenyl)-N-methylbutanamide
CID 143587868

Frequently Asked Questions

What is the IUPAC name of 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide?
The IUPAC name of 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide (CID 138046134) is 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide.
What is the SMILES notation for 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide?
The canonical SMILES for 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide is CCc1cccc(N(C)C(=O)Nc2cccc(C(N)=O)c2)c1.
What is the InChIKey of 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide?
The InChIKey is GRZFGIAVPJKSIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-3-12-6-4-9-15(10-12)20(2)17(22)19-14-8-5-7-13(11-14)16(18)21/h4-11H,3H2,1-2H3,(H2,18,21)(H,19,22).
What are the key properties of 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide?
3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide has a molecular weight of 297.36 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3-ethylphenyl)-methylcarbamoyl]amino]benzamide is sourced from PubChem (CID 138046134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).