1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane

C14H26 — CID 123752649

IUPAC1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane
SMILESC=CC(C)C(C)(C)CC1C(C)C1CC
InChIInChI=1S/C14H26/c1-7-10(3)14(5,6)9-13-11(4)12(13)8-2/h7,10-13H,1,8-9H2,2-6H3
InChIKeyGPHFMHKUBWJGPZ-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.52
Rot. Bonds5

About 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane

1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane (PubChem CID 123752649) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane.

Molecular Properties

Compound Name1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane
PubChem CID123752649
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane
SMILESC=CC(C)C(C)(C)CC1C(C)C1CC
InChIInChI=1S/C14H26/c1-7-10(3)14(5,6)9-13-11(4)12(13)8-2/h7,10-13H,1,8-9H2,2-6H3
InChIKeyGPHFMHKUBWJGPZ-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.52
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

4-ethyl-3,4-dimethylhex-1-ene
CID 19044878
1,2-diethyl-3,4-dimethylcyclobutane
CID 91590074
1-(2-ethyl-3-methylcyclopropyl)-3-methylbutan-2-amine
CID 155273756
1,2,4-triethyl-3-methyl-5-propan-2-ylcyclopentane
CID 123693329
1-ethyl-2-[2-(2-ethyl-3-methylcyclopropyl)ethyl]-3-methylcyclopropane
CID 90777753
cis-(2R,3S)-1-ethyl-2,3-dimethylcyclopropane
CID 59954456
but-1-ene;3,3-dimethylbut-1-ene;3-methylbut-1-ene;prop-1-ene
CID 174863450
3,5,6,6-tetramethyloct-1-ene
CID 123650579
1-butan-2-yl-2-ethyl-4-(2-ethylbutyl)-3-methylcyclobutane
CID 123211802
(5R)-1-ethyl-2,3,4,5,6-pentamethylcyclohexane
CID 143806596
2-(2-ethyl-3-methylcyclopropyl)ethanol
CID 91526803
2-[[2-[1-(2-ethyl-3-methylcyclopropyl)propan-2-yl]-3-methylcyclopropyl]methyl]-3,5-dimethylbicyclo[2.1.0]pentane
CID 123575155

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane?
The IUPAC name of 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane (CID 123752649) is 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane.
What is the SMILES notation for 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane?
The canonical SMILES for 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane is C=CC(C)C(C)(C)CC1C(C)C1CC.
What is the InChIKey of 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane?
The InChIKey is GPHFMHKUBWJGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-7-10(3)14(5,6)9-13-11(4)12(13)8-2/h7,10-13H,1,8-9H2,2-6H3.
What are the key properties of 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane?
1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane has a molecular weight of 194.36 g/mol, XLogP of 4.52, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-3-(2,2,3-trimethylpent-4-enyl)cyclopropane is sourced from PubChem (CID 123752649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).