5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene

C15H24 — CID 172685723

IUPAC5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene
SMILESCC12C=CC(C(C3CCCC3)C1)C2(C)C
InChIInChI=1S/C15H24/c1-14(2)13-8-9-15(14,3)10-12(13)11-6-4-5-7-11/h8-9,11-13H,4-7,10H2,1-3H3
InChIKeyAZWOIZVDKKUXTI-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.41
Rot. Bonds1

About 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene

5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene (PubChem CID 172685723) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene.

Molecular Properties

Compound Name5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene
PubChem CID172685723
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene
SMILESCC12C=CC(C(C3CCCC3)C1)C2(C)C
InChIInChI=1S/C15H24/c1-14(2)13-8-9-15(14,3)10-12(13)11-6-4-5-7-11/h8-9,11-13H,4-7,10H2,1-3H3
InChIKeyAZWOIZVDKKUXTI-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.41
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

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CID 67585053
6-cyclohexyl-4,4-dimethylcyclohex-2-ene-1-carbaldehyde
CID 174431333
1-methyltricyclo[8.2.1.02,9]tridec-11-ene
CID 91123416
(2,2-dimethylcyclopropyl)cyclopentane
CID 90922823
5-cyclohexyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 59124996
(2-cyclopropylcyclobutyl)cyclopentane
CID 54374966
spiro[1,3,3a,4,5,6,7,7a-octahydroindene-2,5'-cyclopenta-1,3-diene]
CID 59742037
(8R,9R,10S,13S,14S)-13-methyl-2,3,4,5,6,7,8,9,10,11,12,14-dodecahydro-1H-cyclopenta[a]phenanthren-17-one
CID 57349361
[2-(1-methylcyclopropyl)cyclopropyl]cyclohexane
CID 91539241
1-(2-cycloheptyl-4,4-dimethylcyclohexyl)-N-methylmethanamine
CID 82935731
8-methyltricyclo[6.1.1.02,6]decane
CID 123431800
6,6-dimethyl-1,2,3,4,7,7a,8,9,10,11,11a,11b-dodecahydrobenzo[a]quinolizine
CID 3056344

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene?
The IUPAC name of 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene (CID 172685723) is 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene.
What is the SMILES notation for 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene?
The canonical SMILES for 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene is CC12C=CC(C(C3CCCC3)C1)C2(C)C.
What is the InChIKey of 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene?
The InChIKey is AZWOIZVDKKUXTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-14(2)13-8-9-15(14,3)10-12(13)11-6-4-5-7-11/h8-9,11-13H,4-7,10H2,1-3H3.
What are the key properties of 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene?
5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene has a molecular weight of 204.36 g/mol, XLogP of 4.41, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene is sourced from PubChem (CID 172685723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).