4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide

C18H26N2O2 — CID 4109635

IUPAC4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide
SMILESCCCC1CCC(=NNC(=O)c2ccc(OCC)cc2)CC1
InChIInChI=1S/C18H26N2O2/c1-3-5-14-6-10-16(11-7-14)19-20-18(21)15-8-12-17(13-9-15)22-4-2/h8-9,12-14H,3-7,10-11H2,1-2H3,(H,20,21)/b19-16-
InChIKeyLPMUKXAKIZGVIC-MNDPQUGUSA-N
MW302.42 g/mol
LogP4.16
Rot. Bonds6

About 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide

4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide (PubChem CID 4109635) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide
PubChem CID4109635
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide
SMILESCCCC1CCC(=NNC(=O)c2ccc(OCC)cc2)CC1
InChIInChI=1S/C18H26N2O2/c1-3-5-14-6-10-16(11-7-14)19-20-18(21)15-8-12-17(13-9-15)22-4-2/h8-9,12-14H,3-7,10-11H2,1-2H3,(H,20,21)/b19-16-
InChIKeyLPMUKXAKIZGVIC-MNDPQUGUSA-N
XLogP4.16
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide 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

N-[(4-ethylcyclohexylidene)amino]-4-methylbenzamide
CID 3680636
4-chloro-N-[(4-ethylcyclohexylidene)amino]benzamide
CID 5062315
4-ethoxy-N-[(E)-(2-methylcyclohexylidene)amino]benzamide
CID 6381697
N-(cyclohexylideneamino)-4-hexoxybenzamide
CID 4930590
(4-ethoxyphenyl) (4-propylcyclohexyl) carbonate
CID 70557421
N-(cyclooctylideneamino)-4-(2-methylpropoxy)benzamide
CID 54786851
4-decoxy-N-[(E)-(3-methylcyclohexylidene)amino]benzamide
CID 171980771
N-[(4-propylcyclohexylidene)amino]-1H-indole-3-carboxamide
CID 5142375
4-[(4-chlorophenyl)methoxy]-N-(cyclododecylideneamino)benzamide
CID 162787095
N-[(4-propylcyclohexylidene)amino]undecanamide
CID 4226269
N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]benzamide
CID 5240480
4-ethoxy-N-[(E)-(8-hydroxy-5-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)amino]benzamide
CID 135577256

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide?
The IUPAC name of 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide (CID 4109635) is 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide.
What is the SMILES notation for 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide?
The canonical SMILES for 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide is CCCC1CCC(=NNC(=O)c2ccc(OCC)cc2)CC1.
What is the InChIKey of 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide?
The InChIKey is LPMUKXAKIZGVIC-MNDPQUGUSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-3-5-14-6-10-16(11-7-14)19-20-18(21)15-8-12-17(13-9-15)22-4-2/h8-9,12-14H,3-7,10-11H2,1-2H3,(H,20,21)/b19-16-.
What are the key properties of 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide?
4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide has a molecular weight of 302.42 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[(4-propylcyclohexylidene)amino]benzamide is sourced from PubChem (CID 4109635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).