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

C18H28N2O — CID 62180221

IUPACN-(2-cyclohexylethyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCCC2CCCCC2)cc1
InChIInChI=1S/C18H28N2O/c1-2-13-19-17-10-8-16(9-11-17)18(21)20-14-12-15-6-4-3-5-7-15/h8-11,15,19H,2-7,12-14H2,1H3,(H,20,21)
InChIKeyBVFRIXCUZNLWMT-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.21
Rot. Bonds7

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

N-(2-cyclohexylethyl)-4-(propylamino)benzamide (PubChem CID 62180221) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-4-(propylamino)benzamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-4-(propylamino)benzamide
PubChem CID62180221
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-(2-cyclohexylethyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCCC2CCCCC2)cc1
InChIInChI=1S/C18H28N2O/c1-2-13-19-17-10-8-16(9-11-17)18(21)20-14-12-15-6-4-3-5-7-15/h8-11,15,19H,2-7,12-14H2,1H3,(H,20,21)
InChIKeyBVFRIXCUZNLWMT-UHFFFAOYSA-N
XLogP4.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-cyclopentylpropyl)-4-(propylamino)benzamide
CID 106015559
N-(cyclobutylmethyl)-4-(propylamino)benzamide
CID 62170357
N-(2-cyclobutylethyl)-4-(methylamino)benzamide
CID 113479358
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
4-bromo-N-(2-cyclohexylethyl)benzamide
CID 63524562
N-(2-cyclopentylethyl)-4-iodobenzamide
CID 60732288
N-[(2-methylcyclohexyl)methyl]-4-(propylamino)benzamide
CID 62181510
N-cyclobutyl-4-(propylamino)benzamide
CID 55067083
N-pentyl-4-(propylamino)benzamide
CID 62185567
N-(2-cyclohexylethyl)-4-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 60916634
4-(cyclohexanecarbonylamino)-N-propylbenzamide
CID 17218748
1-[4-(2-cyclobutylethylamino)phenyl]ethanone
CID 114468462

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-4-(propylamino)benzamide?
The IUPAC name of N-(2-cyclohexylethyl)-4-(propylamino)benzamide (CID 62180221) is N-(2-cyclohexylethyl)-4-(propylamino)benzamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-4-(propylamino)benzamide?
The canonical SMILES for N-(2-cyclohexylethyl)-4-(propylamino)benzamide is CCCNc1ccc(C(=O)NCCC2CCCCC2)cc1.
What is the InChIKey of N-(2-cyclohexylethyl)-4-(propylamino)benzamide?
The InChIKey is BVFRIXCUZNLWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-13-19-17-10-8-16(9-11-17)18(21)20-14-12-15-6-4-3-5-7-15/h8-11,15,19H,2-7,12-14H2,1H3,(H,20,21).
What are the key properties of N-(2-cyclohexylethyl)-4-(propylamino)benzamide?
N-(2-cyclohexylethyl)-4-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.21, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-4-(propylamino)benzamide is sourced from PubChem (CID 62180221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).