1-ethyl-4-[(E)-prop-1-enyl]cyclohexane

C11H20 — CID 59981886

IUPAC1-ethyl-4-[(E)-prop-1-enyl]cyclohexane
SMILESC/C=C/C1CCC(CC)CC1
InChIInChI=1S/C11H20/c1-3-5-11-8-6-10(4-2)7-9-11/h3,5,10-11H,4,6-9H2,1-2H3/b5-3+
InChIKeyCFQRHJMAFPUBDU-HWKANZROSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds2

About 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane

1-ethyl-4-[(E)-prop-1-enyl]cyclohexane (PubChem CID 59981886) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane.

Molecular Properties

Compound Name1-ethyl-4-[(E)-prop-1-enyl]cyclohexane
PubChem CID59981886
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1-ethyl-4-[(E)-prop-1-enyl]cyclohexane
SMILESC/C=C/C1CCC(CC)CC1
InChIInChI=1S/C11H20/c1-3-5-11-8-6-10(4-2)7-9-11/h3,5,10-11H,4,6-9H2,1-2H3/b5-3+
InChIKeyCFQRHJMAFPUBDU-HWKANZROSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-4-[2-(4-ethylcyclohexyl)ethenyl]cyclohexane
CID 140739356
1-ethyl-4-[(E)-4-(4-prop-1-enylcyclohexyl)but-1-enyl]cyclohexane
CID 173282061
1-(2-bromoethenyl)-4-ethylcyclohexane
CID 173341809
1-cyclopropyl-4-[[4-[(E)-prop-1-enyl]cyclohexyl]methyl]cyclohexane
CID 158220965
1-ethyl-4-[(E)-4-[4-[(E)-pent-3-enyl]cyclohexyl]but-1-enyl]cyclohexane
CID 19070206
1-[(E)-prop-1-enyl]-4-[(4-propylcyclohexyl)methyl]cyclohexane
CID 143761309
1-ethyl-4-(2-methoxyethenyl)cyclohexane
CID 91328086
4-[(E)-prop-1-enyl]cyclohexan-1-amine
CID 54523071
(3S,4S)-4-[4-(4-ethylcyclohexyl)cyclohexyl]-2,2-difluoro-3-(4-prop-1-enylcyclohexyl)oxetane
CID 91557947
1-prop-1-enyl-4-[(Z)-4-(4-propylcyclohexyl)but-2-enyl]cyclohexane
CID 173281372
[4-(4-prop-1-enylcyclohexyl)cyclohexyl]methanol
CID 54475864
1-but-1-enyl-4-(4-prop-1-enylcyclohexyl)cyclohexane;methane
CID 158214961

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane?
The IUPAC name of 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane (CID 59981886) is 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane.
What is the SMILES notation for 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane?
The canonical SMILES for 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane is C/C=C/C1CCC(CC)CC1.
What is the InChIKey of 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane?
The InChIKey is CFQRHJMAFPUBDU-HWKANZROSA-N. The full InChI is InChI=1S/C11H20/c1-3-5-11-8-6-10(4-2)7-9-11/h3,5,10-11H,4,6-9H2,1-2H3/b5-3+.
What are the key properties of 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane?
1-ethyl-4-[(E)-prop-1-enyl]cyclohexane has a molecular weight of 152.28 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[(E)-prop-1-enyl]cyclohexane is sourced from PubChem (CID 59981886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).