1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane

C11H18 — CID 174071614

IUPAC1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane
SMILESC=CCC1CC(C)(C)CC1=C
InChIInChI=1S/C11H18/c1-5-6-10-8-11(3,4)7-9(10)2/h5,10H,1-2,6-8H2,3-4H3
InChIKeyKCMHYGFTPLZCRY-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.55
Rot. Bonds2

About 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane

1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane (PubChem CID 174071614) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane.

Molecular Properties

Compound Name1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane
PubChem CID174071614
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane
SMILESC=CCC1CC(C)(C)CC1=C
InChIInChI=1S/C11H18/c1-5-6-10-8-11(3,4)7-9(10)2/h5,10H,1-2,6-8H2,3-4H3
InChIKeyKCMHYGFTPLZCRY-UHFFFAOYSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane?
The IUPAC name of 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane (CID 174071614) is 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane.
What is the SMILES notation for 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane?
The canonical SMILES for 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane is C=CCC1CC(C)(C)CC1=C.
What is the InChIKey of 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane?
The InChIKey is KCMHYGFTPLZCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-5-6-10-8-11(3,4)7-9(10)2/h5,10H,1-2,6-8H2,3-4H3.
What are the key properties of 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane?
1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane has a molecular weight of 150.26 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-methylidene-4-prop-2-enylcyclopentane is sourced from PubChem (CID 174071614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).