(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine

C11H19N — CID 142040872

IUPAC(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine
SMILESC/C=C\C=C1/CCCCC1NC
InChIInChI=1S/C11H19N/c1-3-4-7-10-8-5-6-9-11(10)12-2/h3-4,7,11-12H,5-6,8-9H2,1-2H3/b4-3-,10-7+
InChIKeyZFVBOHFAUUIPRT-HQGAUJLMSA-N
MW165.28 g/mol
LogP2.65
Rot. Bonds2

About (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine

(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine (PubChem CID 142040872) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine
PubChem CID142040872
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine
SMILESC/C=C\C=C1/CCCCC1NC
InChIInChI=1S/C11H19N/c1-3-4-7-10-8-5-6-9-11(10)12-2/h3-4,7,11-12H,5-6,8-9H2,1-2H3/b4-3-,10-7+
InChIKeyZFVBOHFAUUIPRT-HQGAUJLMSA-N
XLogP2.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine 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

(1E)-1-[(E)-but-2-enylidene]-2-(2-methylprop-1-enyl)cyclohexane
CID 102151765
1-but-2-enylidene-2-prop-1-enylcyclopentane
CID 131859563
(1Z,2Z)-1-[(Z)-but-2-enylidene]-2-ethylidenecyclohexane;ethane
CID 142131776
(1Z,2Z)-1-[(Z)-but-2-enylidene]-2-ethylidenecycloheptane;ethane
CID 143536598
(1E,2S)-1-ethylidene-2-methylcyclohexane
CID 148695286
N-methyl-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amine
CID 83208086
N-methyl-5,6,7,8,9,10-hexahydrobenzo[8]annulen-5-amine
CID 123748338
N,2-dimethyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrrol-4-amine
CID 83208348
N,1,3-trimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62730070
N-methyl-1,2,3,5,6,7-hexahydro-s-indacen-1-amine
CID 3058652
2-but-2-enylidenecyclododecan-1-one
CID 72612267
2-ethyl-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrrol-4-amine
CID 83208813

Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine?
The IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine (CID 142040872) is (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine.
What is the SMILES notation for (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine?
The canonical SMILES for (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine is C/C=C\C=C1/CCCCC1NC.
What is the InChIKey of (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine?
The InChIKey is ZFVBOHFAUUIPRT-HQGAUJLMSA-N. The full InChI is InChI=1S/C11H19N/c1-3-4-7-10-8-5-6-9-11(10)12-2/h3-4,7,11-12H,5-6,8-9H2,1-2H3/b4-3-,10-7+.
What are the key properties of (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine?
(2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine has a molecular weight of 165.28 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-but-2-enylidene]-N-methylcyclohexan-1-amine is sourced from PubChem (CID 142040872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).