1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane

C12H20O — CID 143080441

IUPAC1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane
SMILESC=C(C)OC(=C)CC1(C)CCCC1
InChIInChI=1S/C12H20O/c1-10(2)13-11(3)9-12(4)7-5-6-8-12/h1,3,5-9H2,2,4H3
InChIKeyANWHELOKOBIHFZ-UHFFFAOYSA-N
MW180.29 g/mol
LogP4.02
Rot. Bonds4

About 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane

1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane (PubChem CID 143080441) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane.

Molecular Properties

Compound Name1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane
PubChem CID143080441
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane
SMILESC=C(C)OC(=C)CC1(C)CCCC1
InChIInChI=1S/C12H20O/c1-10(2)13-11(3)9-12(4)7-5-6-8-12/h1,3,5-9H2,2,4H3
InChIKeyANWHELOKOBIHFZ-UHFFFAOYSA-N
XLogP4.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

7,9-Dimethylidene-8-oxaspiro[4.5]decane
CID 15759299
3-Methylidene-2-oxaspiro[4.4]nonane
CID 135023324
1-(3,3-Dimethylpent-1-en-2-yloxy)-1-methylcyclopentane
CID 59267069
1-(3,3-Dimethylpent-1-en-2-yloxy)-1-ethylcyclopentane
CID 66804245
5,7,7-Trimethyl-2-(5,7,7-trimethyloct-1-en-2-yloxy)oct-1-ene
CID 90022781
3-Ethyl-2-prop-1-en-2-yloxyhept-1-ene
CID 91605523
3-(1-Methylcyclopentyl)prop-1-en-2-ol
CID 118228795
4-Ethyl-4-(2-ethylbutyl)-2-methylideneoxolane
CID 142091926
1-(1-Ethoxypropa-1,2-dienyl)-1-methyl-3-methylidenecyclopentane
CID 142115926
3-Butyl-2,5-dimethylideneoxolane
CID 145353865
5,5,7,7-Tetramethyl-2-prop-1-en-2-yloxyoct-1-ene
CID 153393091
1-(3-Butoxybut-3-enyl)-1,3-dimethylcyclopentane
CID 156121172

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane?
The IUPAC name of 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane (CID 143080441) is 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane.
What is the SMILES notation for 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane?
The canonical SMILES for 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane is C=C(C)OC(=C)CC1(C)CCCC1.
What is the InChIKey of 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane?
The InChIKey is ANWHELOKOBIHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c1-10(2)13-11(3)9-12(4)7-5-6-8-12/h1,3,5-9H2,2,4H3.
What are the key properties of 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane?
1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane has a molecular weight of 180.29 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-(2-prop-1-en-2-yloxyprop-2-enyl)cyclopentane is sourced from PubChem (CID 143080441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).