N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide

C18H28N2O — CID 62175214

IUPACN-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)N(C)C1CCCCC1C
InChIInChI=1S/C18H28N2O/c1-4-13-19-16-11-7-6-10-15(16)18(21)20(3)17-12-8-5-9-14(17)2/h6-7,10-11,14,17,19H,4-5,8-9,12-13H2,1-3H3
InChIKeyLKVNUCSHKCWPEC-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.16
Rot. Bonds5

About N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide

N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide (PubChem CID 62175214) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide
PubChem CID62175214
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)N(C)C1CCCCC1C
InChIInChI=1S/C18H28N2O/c1-4-13-19-16-11-7-6-10-15(16)18(21)20(3)17-12-8-5-9-14(17)2/h6-7,10-11,14,17,19H,4-5,8-9,12-13H2,1-3H3
InChIKeyLKVNUCSHKCWPEC-UHFFFAOYSA-N
XLogP4.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-methyl-2-(propylamino)benzamide
CID 62169629
N-butyl-N-cyclopropyl-2-(propylamino)benzamide
CID 62179116
N-methyl-N-(2-methylcyclohexyl)-4-(propylamino)pyridine-2-carboxamide
CID 62175380
N,N-diethyl-2-(propylamino)benzamide
CID 62171276
N-(2-hydroxypropyl)-N-methyl-2-(propylamino)benzamide
CID 55061041
N-cyclooctyl-2-(propylamino)benzamide
CID 63500402
N-methyl-N-propan-2-yl-2-(propylamino)benzamide
CID 62166178
N-(2-hydroxycyclohexyl)-2-(propylamino)benzamide
CID 62361158
N-[(4-methylcyclohexyl)methyl]-2-(propylamino)benzamide
CID 63501540
N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 63107687
N-methyl-N-(4-methylpentan-2-yl)-2-(propylamino)benzamide
CID 62177403
5-amino-N,2-dimethyl-N-(2-methylcyclohexyl)benzamide
CID 61291362

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide (CID 62175214) is N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)N(C)C1CCCCC1C.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide?
The InChIKey is LKVNUCSHKCWPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-13-19-16-11-7-6-10-15(16)18(21)20(3)17-12-8-5-9-14(17)2/h6-7,10-11,14,17,19H,4-5,8-9,12-13H2,1-3H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide?
N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-2-(propylamino)benzamide is sourced from PubChem (CID 62175214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).