5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide

C16H24N2O — CID 61466325

IUPAC5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
SMILESCCC1CCC(NC(=O)c2cc(N)ccc2C)CC1
InChIInChI=1S/C16H24N2O/c1-3-12-5-8-14(9-6-12)18-16(19)15-10-13(17)7-4-11(15)2/h4,7,10,12,14H,3,5-6,8-9,17H2,1-2H3,(H,18,19)
InChIKeyBIBQUEZASCPNLQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.28
Rot. Bonds3

About 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide

5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide (PubChem CID 61466325) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide.

Molecular Properties

Compound Name5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
PubChem CID61466325
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
SMILESCCC1CCC(NC(=O)c2cc(N)ccc2C)CC1
InChIInChI=1S/C16H24N2O/c1-3-12-5-8-14(9-6-12)18-16(19)15-10-13(17)7-4-11(15)2/h4,7,10,12,14H,3,5-6,8-9,17H2,1-2H3,(H,18,19)
InChIKeyBIBQUEZASCPNLQ-UHFFFAOYSA-N
XLogP3.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-(4-carbamoylcyclohexyl)-2-methylbenzamide
CID 61291951
N-(4-ethylcyclohexyl)-4-fluoro-2-methylbenzamide
CID 112702388
5-amino-N-(1-cyclopentylpiperidin-4-yl)-2-methylbenzamide
CID 120641743
2-amino-N-(4-ethylcyclohexyl)-4-fluorobenzamide
CID 63110662
N-(4-ethylcyclohexyl)-2-hydrazinyl-5-methylbenzamide
CID 62511302
5-amino-N-cyclopropyl-2-(propylamino)benzamide
CID 100638190
3-[(5-amino-2-methylbenzoyl)amino]-N-ethylpyrrolidine-1-carboxamide;hydrochloride
CID 120638870
5-amino-2-methyl-N-[1-(3-methylbutanoyl)piperidin-4-yl]benzamide;hydrochloride
CID 120626448
5-amino-N-(cyclobutylmethyl)-2-methylbenzamide;hydrochloride
CID 120622474
5-amino-2-[(4-ethylcyclohexyl)amino]benzamide
CID 61468335
5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64655482
5-amino-N-(3-ethylcyclohexyl)-2-fluorobenzamide
CID 64748209

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide?
The IUPAC name of 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide (CID 61466325) is 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide.
What is the SMILES notation for 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide?
The canonical SMILES for 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide is CCC1CCC(NC(=O)c2cc(N)ccc2C)CC1.
What is the InChIKey of 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide?
The InChIKey is BIBQUEZASCPNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-12-5-8-14(9-6-12)18-16(19)15-10-13(17)7-4-11(15)2/h4,7,10,12,14H,3,5-6,8-9,17H2,1-2H3,(H,18,19).
What are the key properties of 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide?
5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide has a molecular weight of 260.38 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide is sourced from PubChem (CID 61466325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).