(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine

C11H19N — CID 123994519

IUPAC(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine
SMILESC/C=C1/CC(C)(C)CC/C1=N\C
InChIInChI=1S/C11H19N/c1-5-9-8-11(2,3)7-6-10(9)12-4/h5H,6-8H2,1-4H3/b9-5-,12-10+
InChIKeyMNDNZBWRSBOQOK-VVVIWDQOSA-N
MW165.28 g/mol
LogP3.21
Rot. Bonds

About (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine

(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine (PubChem CID 123994519) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine.

Molecular Properties

Compound Name(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine
PubChem CID123994519
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine
SMILESC/C=C1/CC(C)(C)CC/C1=N\C
InChIInChI=1S/C11H19N/c1-5-9-8-11(2,3)7-6-10(9)12-4/h5H,6-8H2,1-4H3/b9-5-,12-10+
InChIKeyMNDNZBWRSBOQOK-VVVIWDQOSA-N
XLogP3.21
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-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

3,5,5-trimethyl-N-(2,2,2-trifluoroethyl)cyclohex-2-en-1-imine
CID 70518262
Ethyl-(3,5,5-trimethyl-cyclohex-2-enylidene)-amine
CID 11205971
3,5,5-trimethyl-N-(2-methylpropyl)cyclohex-2-en-1-imine
CID 70516911
N,2,5,5-tetramethylcyclohex-2-en-1-imine
CID 86038796
(1Z)-3,5,5-Trimethyl-N-(prop-2-en-1-yl)cyclohex-2-en-1-imine
CID 238062
N-methyl-3,4-di(propan-2-yl)cyclohex-2-en-1-imine
CID 20631046
(5E,9E)-2-[2-(1-propylcyclohexyl)ethyl]-1-azacyclododeca-1,5,9-triene
CID 22816624
N,4a,5-trimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydronaphthalen-1-imine
CID 58587127
N,2,2,7-tetramethyloct-6-en-3-imine
CID 58590902
N,2,3-trimethylcyclohex-3-en-1-imine
CID 68029995
N,3,5,5-tetramethylcyclohex-2-en-1-imine
CID 70518167
(6Z)-N-methyl-2-propan-2-yl-6-prop-2-enylidenecyclohexan-1-imine
CID 88874929

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine?
The IUPAC name of (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine (CID 123994519) is (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine.
What is the SMILES notation for (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine?
The canonical SMILES for (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine is C/C=C1/CC(C)(C)CC/C1=N\C.
What is the InChIKey of (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine?
The InChIKey is MNDNZBWRSBOQOK-VVVIWDQOSA-N. The full InChI is InChI=1S/C11H19N/c1-5-9-8-11(2,3)7-6-10(9)12-4/h5H,6-8H2,1-4H3/b9-5-,12-10+.
What are the key properties of (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine?
(2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine has a molecular weight of 165.28 g/mol, XLogP of 3.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-ethylidene-N,4,4-trimethylcyclohexan-1-imine is sourced from PubChem (CID 123994519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).