1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane

C15H22 — CID 14688282

IUPAC1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane
SMILESCC(C)=C1C=CC(C2(C)CCCCC2)=C1
InChIInChI=1S/C15H22/c1-12(2)13-7-8-14(11-13)15(3)9-5-4-6-10-15/h7-8,11H,4-6,9-10H2,1-3H3
InChIKeyFSYWBVYXZAJYLX-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.79
Rot. Bonds1

About 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane

1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane (PubChem CID 14688282) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane.

Molecular Properties

Compound Name1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane
PubChem CID14688282
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane
SMILESCC(C)=C1C=CC(C2(C)CCCCC2)=C1
InChIInChI=1S/C15H22/c1-12(2)13-7-8-14(11-13)15(3)9-5-4-6-10-15/h7-8,11H,4-6,9-10H2,1-3H3
InChIKeyFSYWBVYXZAJYLX-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane?
The IUPAC name of 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane (CID 14688282) is 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane.
What is the SMILES notation for 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane?
The canonical SMILES for 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane is CC(C)=C1C=CC(C2(C)CCCCC2)=C1.
What is the InChIKey of 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane?
The InChIKey is FSYWBVYXZAJYLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-12(2)13-7-8-14(11-13)15(3)9-5-4-6-10-15/h7-8,11H,4-6,9-10H2,1-3H3.
What are the key properties of 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane?
1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane has a molecular weight of 202.34 g/mol, XLogP of 4.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane is sourced from PubChem (CID 14688282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).