5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide

C18H28N2O — CID 63500938

IUPAC5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1CCC(C)CC1
InChIInChI=1S/C18H28N2O/c1-4-11-19-17-10-7-14(3)12-16(17)18(21)20-15-8-5-13(2)6-9-15/h7,10,12-13,15,19H,4-6,8-9,11H2,1-3H3,(H,20,21)
InChIKeyADISBIJIOPKBGJ-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.13
Rot. Bonds5

About 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide

5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide (PubChem CID 63500938) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide.

Molecular Properties

Compound Name5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
PubChem CID63500938
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1CCC(C)CC1
InChIInChI=1S/C18H28N2O/c1-4-11-19-17-10-7-14(3)12-16(17)18(21)20-15-8-5-13(2)6-9-15/h7,10,12-13,15,19H,4-6,8-9,11H2,1-3H3,(H,20,21)
InChIKeyADISBIJIOPKBGJ-UHFFFAOYSA-N
XLogP4.13
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-5-methyl-2-(propylamino)benzamide
CID 62509311
5-methyl-2-(methylamino)-N-(4-methylcyclohexyl)benzamide
CID 55083319
5-amino-N-cyclopropyl-2-(propylamino)benzamide
CID 100638190
N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
CID 62510099
N-(4-ethylcyclohexyl)-2-hydrazinyl-5-methylbenzamide
CID 62511302
5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
CID 113485988
5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
CID 55083225
2-(ethylamino)-N-(4-methylcyclohexyl)benzamide
CID 62171591
5-methyl-2-(propylamino)-N-(thiolan-2-ylmethyl)benzamide
CID 80586079
5-methyl-N-(oxolan-2-ylmethyl)-2-(propylamino)benzamide
CID 62509999
5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499534
N-(2,3-dimethylcyclopentyl)-2-(ethylamino)-5-methylbenzamide
CID 64922871

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide?
The IUPAC name of 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide (CID 63500938) is 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide.
What is the SMILES notation for 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide?
The canonical SMILES for 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)NC1CCC(C)CC1.
What is the InChIKey of 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide?
The InChIKey is ADISBIJIOPKBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-11-19-17-10-7-14(3)12-16(17)18(21)20-15-8-5-13(2)6-9-15/h7,10,12-13,15,19H,4-6,8-9,11H2,1-3H3,(H,20,21).
What are the key properties of 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide?
5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide is sourced from PubChem (CID 63500938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).