5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide

C18H28N2O — CID 63499534

IUPAC5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1(C)CCCCC1
InChIInChI=1S/C18H28N2O/c1-4-12-19-16-9-8-14(2)13-15(16)17(21)20-18(3)10-6-5-7-11-18/h8-9,13,19H,4-7,10-12H2,1-3H3,(H,20,21)
InChIKeyGYQUMFWZOOGRBQ-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.27
Rot. Bonds5

About 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide

5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide (PubChem CID 63499534) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide.

Molecular Properties

Compound Name5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
PubChem CID63499534
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1(C)CCCCC1
InChIInChI=1S/C18H28N2O/c1-4-12-19-16-9-8-14(2)13-15(16)17(21)20-18(3)10-6-5-7-11-18/h8-9,13,19H,4-7,10-12H2,1-3H3,(H,20,21)
InChIKeyGYQUMFWZOOGRBQ-UHFFFAOYSA-N
XLogP4.27
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 ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
CID 113485988
6-methyl-N-(1-methylcyclohexyl)-4-(propylamino)pyridine-3-carboxamide
CID 81238446
N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
CID 81245301
N-cyclohexyl-5-methyl-2-(propylamino)benzamide
CID 62509311
2-bromo-5-methyl-N-(1-methylcyclohexyl)benzamide
CID 80972166
5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
CID 55083225
2-bromo-5-methyl-N-(1-methylcyclopentyl)benzamide
CID 80987670
2-hydroxy-4-methyl-N-(1-methylcyclohexyl)benzamide
CID 61216850
5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
CID 63500938
3-fluoro-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499533
N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
CID 62510099
5-methyl-N-(oxolan-2-ylmethyl)-2-(propylamino)benzamide
CID 62509999

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide?
The IUPAC name of 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide (CID 63499534) is 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide.
What is the SMILES notation for 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide?
The canonical SMILES for 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)NC1(C)CCCCC1.
What is the InChIKey of 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide?
The InChIKey is GYQUMFWZOOGRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-12-19-16-9-8-14(2)13-15(16)17(21)20-18(3)10-6-5-7-11-18/h8-9,13,19H,4-7,10-12H2,1-3H3,(H,20,21).
What are the key properties of 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide?
5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide is sourced from PubChem (CID 63499534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).