2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide

C18H20N2O2 — CID 4945880

IUPAC2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
SMILESCCCNC(=O)c1ccccc1NC(=O)c1ccccc1C
InChIInChI=1S/C18H20N2O2/c1-3-12-19-17(21)15-10-6-7-11-16(15)20-18(22)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyHQLRONFRJKMCHR-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.39
Rot. Bonds5

About 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide

2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide (PubChem CID 4945880) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
PubChem CID4945880
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
SMILESCCCNC(=O)c1ccccc1NC(=O)c1ccccc1C
InChIInChI=1S/C18H20N2O2/c1-3-12-19-17(21)15-10-6-7-11-16(15)20-18(22)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyHQLRONFRJKMCHR-UHFFFAOYSA-N
XLogP3.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 34748509
3-iodo-4-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4945980
2-hydrazinyl-N-propylbenzamide
CID 62238054
2-(2-methylpropanoylamino)-N-propylbenzamide
CID 31287518
3,5-difluoro-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 8750781
1-methyl-4-[(2-methylbenzoyl)amino]-N-propylpyrazole-5-carboxamide
CID 4865439
N-propyl-2-[(2,2,2-trifluoroacetyl)amino]benzamide
CID 63374871
2-methyl-N-[2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 27241616
2-[[(2R)-2-chloropropanoyl]amino]-N-propylbenzamide
CID 92660374
2-[[(2S)-2-chloropropanoyl]amino]-N-propylbenzamide
CID 92660375
N-hexyl-2-methylbenzamide
CID 3017102
2-[(3-fluorobenzoyl)amino]-N-propylbenzamide
CID 8002041

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The IUPAC name of 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide (CID 4945880) is 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide is CCCNC(=O)c1ccccc1NC(=O)c1ccccc1C.
What is the InChIKey of 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The InChIKey is HQLRONFRJKMCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-3-12-19-17(21)15-10-6-7-11-16(15)20-18(22)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide has a molecular weight of 296.37 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 4945880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).