1-ethenylcyclohexene;methylidenecyclopropane

C12H18 — CID 159160472

IUPAC1-ethenylcyclohexene;methylidenecyclopropane
SMILESC=C1CC1.C=CC1=CCCCC1
InChIInChI=1S/C8H12.C4H6/c1-2-8-6-4-3-5-7-8;1-4-2-3-4/h2,6H,1,3-5,7H2;1-3H2
InChIKeyKKKQNWRPAPINQM-UHFFFAOYSA-N
MW162.28 g/mol
LogP4.01
Rot. Bonds1

About 1-ethenylcyclohexene;methylidenecyclopropane

1-ethenylcyclohexene;methylidenecyclopropane (PubChem CID 159160472) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is 1-ethenylcyclohexene;methylidenecyclopropane.

Molecular Properties

Compound Name1-ethenylcyclohexene;methylidenecyclopropane
PubChem CID159160472
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name1-ethenylcyclohexene;methylidenecyclopropane
SMILESC=C1CC1.C=CC1=CCCCC1
InChIInChI=1S/C8H12.C4H6/c1-2-8-6-4-3-5-7-8;1-4-2-3-4/h2,6H,1,3-5,7H2;1-3H2
InChIKeyKKKQNWRPAPINQM-UHFFFAOYSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-ethenylcyclohexene;methylidenecyclopropane 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

1-ethenylcyclooctene
CID 54012738
(1Z,3E,5E)-cyclododeca-1,3,5-triene;1-ethenylcyclohexene
CID 141453701
(1E)-cyclononene-1-carbaldehyde
CID 22647283
1-propa-1,2-dienylcyclooctene
CID 174562803
1-ethenylcyclohexene;2-tetradecyloxirane
CID 158468491
1-[(Z)-prop-1-enyl]cycloheptene
CID 135080303
2-(cyclohexen-1-yl)-N,N-dimethylethenamine
CID 71333973
acetic acid;cyclohexene-1-carbaldehyde
CID 175385909
1-ethenylcyclobutene;3-ethenylcyclobutene
CID 23196725
N-ethenylcyclohexen-1-amine
CID 67050822
(1Z,4Z)-1,5-di(cyclohexen-1-yl)-2,4-dimethylpenta-1,4-dien-3-one
CID 70617483
3-[(1E)-cycloocten-1-yl]prop-2-enoic acid
CID 70063613

Frequently Asked Questions

What is the IUPAC name of 1-ethenylcyclohexene;methylidenecyclopropane?
The IUPAC name of 1-ethenylcyclohexene;methylidenecyclopropane (CID 159160472) is 1-ethenylcyclohexene;methylidenecyclopropane.
What is the SMILES notation for 1-ethenylcyclohexene;methylidenecyclopropane?
The canonical SMILES for 1-ethenylcyclohexene;methylidenecyclopropane is C=C1CC1.C=CC1=CCCCC1.
What is the InChIKey of 1-ethenylcyclohexene;methylidenecyclopropane?
The InChIKey is KKKQNWRPAPINQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12.C4H6/c1-2-8-6-4-3-5-7-8;1-4-2-3-4/h2,6H,1,3-5,7H2;1-3H2.
What are the key properties of 1-ethenylcyclohexene;methylidenecyclopropane?
1-ethenylcyclohexene;methylidenecyclopropane has a molecular weight of 162.28 g/mol, XLogP of 4.01, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylcyclohexene;methylidenecyclopropane is sourced from PubChem (CID 159160472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).