N-(4-methylphenyl)-4-(pentanoylamino)benzamide

C19H22N2O2 — CID 4630697

IUPACN-(4-methylphenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C19H22N2O2/c1-3-4-5-18(22)20-16-12-8-15(9-13-16)19(23)21-17-10-6-14(2)7-11-17/h6-13H,3-5H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKDLACMHRVCAPAG-UHFFFAOYSA-N
MW310.40 g/mol
LogP4.38
Rot. Bonds6

About N-(4-methylphenyl)-4-(pentanoylamino)benzamide

N-(4-methylphenyl)-4-(pentanoylamino)benzamide (PubChem CID 4630697) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(4-methylphenyl)-4-(pentanoylamino)benzamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-4-(pentanoylamino)benzamide
PubChem CID4630697
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(4-methylphenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C19H22N2O2/c1-3-4-5-18(22)20-16-12-8-15(9-13-16)19(23)21-17-10-6-14(2)7-11-17/h6-13H,3-5H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKDLACMHRVCAPAG-UHFFFAOYSA-N
XLogP4.38
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylphenyl)pentanamide
CID 3662375
N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide
CID 4630686
4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
1-N-butyl-4-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109043732
N-[4-[[[6-oxo-6-[2-[4-(pentanoylamino)benzoyl]hydrazinyl]hexanoyl]amino]carbamoyl]phenyl]pentanamide
CID 4926555
N-(2,4-dimethylphenyl)-4-(hexanoylamino)benzamide
CID 3645447
N-[4-[3-(diethylamino)propanoylamino]phenyl]-4-methylbenzamide
CID 50955133
N-[4-[(hexanoylamino)carbamoyl]phenyl]pentanamide
CID 4953980
N-[4-(heptanoylamino)phenyl]benzamide
CID 54789055
N-(4-methyl-2-pyridinyl)-4-(pentanoylamino)benzamide
CID 4630518
N-[4-(ethylsulfamoyl)phenyl]-4-(pentanoylamino)benzamide
CID 2229397
N-[4-[(octanoylamino)carbamoyl]phenyl]pentanamide
CID 4958829

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-4-(pentanoylamino)benzamide?
The IUPAC name of N-(4-methylphenyl)-4-(pentanoylamino)benzamide (CID 4630697) is N-(4-methylphenyl)-4-(pentanoylamino)benzamide.
What is the SMILES notation for N-(4-methylphenyl)-4-(pentanoylamino)benzamide?
The canonical SMILES for N-(4-methylphenyl)-4-(pentanoylamino)benzamide is CCCCC(=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-4-(pentanoylamino)benzamide?
The InChIKey is KDLACMHRVCAPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-4-5-18(22)20-16-12-8-15(9-13-16)19(23)21-17-10-6-14(2)7-11-17/h6-13H,3-5H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(4-methylphenyl)-4-(pentanoylamino)benzamide?
N-(4-methylphenyl)-4-(pentanoylamino)benzamide has a molecular weight of 310.40 g/mol, XLogP of 4.38, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-4-(pentanoylamino)benzamide is sourced from PubChem (CID 4630697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).