N-ethyl-2-propan-2-ylidenecyclohexan-1-imine

C11H19N — CID 142128132

IUPACN-ethyl-2-propan-2-ylidenecyclohexan-1-imine
SMILESCC/N=C1\CCCCC1=C(C)C
InChIInChI=1S/C11H19N/c1-4-12-11-8-6-5-7-10(11)9(2)3/h4-8H2,1-3H3/b12-11+
InChIKeyCDXZAQDMHSJNOF-VAWYXSNFSA-N
MW165.28 g/mol
LogP3.36
Rot. Bonds1

About N-ethyl-2-propan-2-ylidenecyclohexan-1-imine

N-ethyl-2-propan-2-ylidenecyclohexan-1-imine (PubChem CID 142128132) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is N-ethyl-2-propan-2-ylidenecyclohexan-1-imine.

Molecular Properties

Compound NameN-ethyl-2-propan-2-ylidenecyclohexan-1-imine
PubChem CID142128132
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC NameN-ethyl-2-propan-2-ylidenecyclohexan-1-imine
SMILESCC/N=C1\CCCCC1=C(C)C
InChIInChI=1S/C11H19N/c1-4-12-11-8-6-5-7-10(11)9(2)3/h4-8H2,1-3H3/b12-11+
InChIKeyCDXZAQDMHSJNOF-VAWYXSNFSA-N
XLogP3.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-ethyl-2-propan-2-ylidenecyclohexan-1-imine 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-Ethyl-4-(propan-2-ylidene)-3,4-dihydro-2H-pyrrole
CID 13272518
(E)-N-ethyl-5-fluoro-4-methylhex-4-en-3-imine
CID 89104249
(E)-N,3-diethyl-4-fluoropent-3-en-2-imine
CID 89207606
(E)-N,4-diethyl-5-fluorohex-4-en-3-imine
CID 89330768
4-Fluoro-5,6-dimethyl-2-propyl-2,3-dihydropyridine
CID 90846019
6-Ethyl-4-fluoro-5-methyl-2-propyl-2,3-dihydropyridine
CID 91588124
N-tert-butyl-2-cyclohexylidenepropan-1-imine
CID 134889888
1-N,4-N,2,3,5,6-hexamethylcyclohexa-2,5-diene-1,4-diimine
CID 18739815
2,5-dimethyl-N,4-di(propan-2-yl)hex-4-en-3-imine
CID 20647017
N,2,3-trimethylcyclohex-2-en-1-imine
CID 21303745
N,2,3-trimethylcyclopent-2-en-1-imine
CID 21303746
1-N,2-N,3,4,5,6-hexamethylcyclohexa-3,5-diene-1,2-diimine
CID 22979280

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-propan-2-ylidenecyclohexan-1-imine?
The IUPAC name of N-ethyl-2-propan-2-ylidenecyclohexan-1-imine (CID 142128132) is N-ethyl-2-propan-2-ylidenecyclohexan-1-imine.
What is the SMILES notation for N-ethyl-2-propan-2-ylidenecyclohexan-1-imine?
The canonical SMILES for N-ethyl-2-propan-2-ylidenecyclohexan-1-imine is CC/N=C1\CCCCC1=C(C)C.
What is the InChIKey of N-ethyl-2-propan-2-ylidenecyclohexan-1-imine?
The InChIKey is CDXZAQDMHSJNOF-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H19N/c1-4-12-11-8-6-5-7-10(11)9(2)3/h4-8H2,1-3H3/b12-11+.
What are the key properties of N-ethyl-2-propan-2-ylidenecyclohexan-1-imine?
N-ethyl-2-propan-2-ylidenecyclohexan-1-imine has a molecular weight of 165.28 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-propan-2-ylidenecyclohexan-1-imine is sourced from PubChem (CID 142128132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).