2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide

C19H22N2O2 — CID 34748509

IUPAC2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide
SMILESCCCNC(=O)c1ccccc1NC(=O)c1ccc(C)cc1C
InChIInChI=1S/C19H22N2O2/c1-4-11-20-18(22)16-7-5-6-8-17(16)21-19(23)15-10-9-13(2)12-14(15)3/h5-10,12H,4,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyBPKWECSLPVKOKF-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.70
Rot. Bonds5

About 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide

2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide (PubChem CID 34748509) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide
PubChem CID34748509
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide
SMILESCCCNC(=O)c1ccccc1NC(=O)c1ccc(C)cc1C
InChIInChI=1S/C19H22N2O2/c1-4-11-20-18(22)16-7-5-6-8-17(16)21-19(23)15-10-9-13(2)12-14(15)3/h5-10,12H,4,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyBPKWECSLPVKOKF-UHFFFAOYSA-N
XLogP3.70
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4945880
3-iodo-4-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4945980
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2,4-dimethylbenzamide
CID 34734992
3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4303867
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221
N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-2,4-dimethylbenzamide
CID 51180458
3-methyl-4-nitro-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 8750889
N-[2-(propylcarbamoyl)phenyl]naphthalene-2-carboxamide
CID 8750851
N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide
CID 100720174
3,5-difluoro-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 8750781
N-[2-(ethoxymethyl)phenyl]-2,4-dimethylbenzamide
CID 86821681
4-N-(2,4-dimethylphenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109042965

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The IUPAC name of 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide (CID 34748509) is 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide is CCCNC(=O)c1ccccc1NC(=O)c1ccc(C)cc1C.
What is the InChIKey of 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
The InChIKey is BPKWECSLPVKOKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-4-11-20-18(22)16-7-5-6-8-17(16)21-19(23)15-10-9-13(2)12-14(15)3/h5-10,12H,4,11H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide?
2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 34748509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).