N-(4-methylphenyl)-2-(propylamino)benzamide

C17H20N2O — CID 62166798

IUPACN-(4-methylphenyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C17H20N2O/c1-3-12-18-16-7-5-4-6-15(16)17(20)19-14-10-8-13(2)9-11-14/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyBMQMIUDPSZZQJW-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.07
Rot. Bonds5

About N-(4-methylphenyl)-2-(propylamino)benzamide

N-(4-methylphenyl)-2-(propylamino)benzamide (PubChem CID 62166798) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(propylamino)benzamide
PubChem CID62166798
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(4-methylphenyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C17H20N2O/c1-3-12-18-16-7-5-4-6-15(16)17(20)19-14-10-8-13(2)9-11-14/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyBMQMIUDPSZZQJW-UHFFFAOYSA-N
XLogP4.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylphenyl)-2-(propylamino)benzamide
CID 62171242
2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106347
N-(4-fluorophenyl)-5-methyl-2-(propylamino)benzamide
CID 62510349
2-(ethylsulfonylamino)-N-(4-methylphenyl)benzamide
CID 51179285
N-(4-chlorophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 18205586
N-(4-chlorophenyl)-5-methyl-2-(propylamino)benzamide
CID 63501109
N-(4-iodophenyl)-5-methyl-2-(propylamino)benzamide
CID 63499323
2-ethylsulfonyl-N-(4-methylphenyl)benzamide
CID 17414707
N-(2-fluorophenyl)-2-(propylamino)benzamide
CID 62166035
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(propylamino)benzamide
CID 62167844
2-ethyl-N-(4-methylphenyl)benzamide
CID 20613365
N-(3-chloro-2-methylphenyl)-2-(propylamino)benzamide
CID 62186612

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(propylamino)benzamide?
The IUPAC name of N-(4-methylphenyl)-2-(propylamino)benzamide (CID 62166798) is N-(4-methylphenyl)-2-(propylamino)benzamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(propylamino)benzamide?
The canonical SMILES for N-(4-methylphenyl)-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)Nc1ccc(C)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(propylamino)benzamide?
The InChIKey is BMQMIUDPSZZQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-3-12-18-16-7-5-4-6-15(16)17(20)19-14-10-8-13(2)9-11-14/h4-11,18H,3,12H2,1-2H3,(H,19,20).
What are the key properties of N-(4-methylphenyl)-2-(propylamino)benzamide?
N-(4-methylphenyl)-2-(propylamino)benzamide has a molecular weight of 268.36 g/mol, XLogP of 4.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(propylamino)benzamide is sourced from PubChem (CID 62166798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).