N-[2-methyl-3-(propanoylamino)phenyl]benzamide

C17H18N2O2 — CID 38300041

IUPACN-[2-methyl-3-(propanoylamino)phenyl]benzamide
SMILESCCC(=O)Nc1cccc(NC(=O)c2ccccc2)c1C
InChIInChI=1S/C17H18N2O2/c1-3-16(20)18-14-10-7-11-15(12(14)2)19-17(21)13-8-5-4-6-9-13/h4-11H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyWMOKZWPGGVKXIG-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.60
Rot. Bonds4

About N-[2-methyl-3-(propanoylamino)phenyl]benzamide

N-[2-methyl-3-(propanoylamino)phenyl]benzamide (PubChem CID 38300041) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-[2-methyl-3-(propanoylamino)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-methyl-3-(propanoylamino)phenyl]benzamide
PubChem CID38300041
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-[2-methyl-3-(propanoylamino)phenyl]benzamide
SMILESCCC(=O)Nc1cccc(NC(=O)c2ccccc2)c1C
InChIInChI=1S/C17H18N2O2/c1-3-16(20)18-14-10-7-11-15(12(14)2)19-17(21)13-8-5-4-6-9-13/h4-11H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyWMOKZWPGGVKXIG-UHFFFAOYSA-N
XLogP3.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methyl-3-(propanoylamino)phenyl]-3-phenylmethoxybenzamide
CID 38300494
N-[2-methyl-3-(propanoylamino)phenyl]-3-phenylpropanamide
CID 38300101
N-[2-methyl-3-[[2-(2-methylphenyl)sulfanylacetyl]amino]phenyl]benzamide
CID 55899537
methyl 2-(3-benzamido-2-methylanilino)acetate
CID 47064255
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 38300689
N-[2-methyl-3-(2-phenylethylamino)phenyl]benzamide
CID 112839420
N-[3-[[2-(4-chlorophenoxy)acetyl]amino]-2-methylphenyl]benzamide
CID 55899034
N-(2-methyl-3-phenylphenyl)benzamide
CID 70826263
N-[3-[[2-(benzylamino)-2-oxoethyl]amino]-2-methylphenyl]benzamide
CID 55918836
N-ethyl-4-[[2-[2-methyl-3-(propanoylamino)anilino]-2-oxoethyl]amino]benzamide
CID 54839477
N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide
CID 46760871
N-[3-[[2-(2-chloroanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54810419

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-(propanoylamino)phenyl]benzamide?
The IUPAC name of N-[2-methyl-3-(propanoylamino)phenyl]benzamide (CID 38300041) is N-[2-methyl-3-(propanoylamino)phenyl]benzamide.
What is the SMILES notation for N-[2-methyl-3-(propanoylamino)phenyl]benzamide?
The canonical SMILES for N-[2-methyl-3-(propanoylamino)phenyl]benzamide is CCC(=O)Nc1cccc(NC(=O)c2ccccc2)c1C.
What is the InChIKey of N-[2-methyl-3-(propanoylamino)phenyl]benzamide?
The InChIKey is WMOKZWPGGVKXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-3-16(20)18-14-10-7-11-15(12(14)2)19-17(21)13-8-5-4-6-9-13/h4-11H,3H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-[2-methyl-3-(propanoylamino)phenyl]benzamide?
N-[2-methyl-3-(propanoylamino)phenyl]benzamide has a molecular weight of 282.34 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-(propanoylamino)phenyl]benzamide is sourced from PubChem (CID 38300041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).