1-penta-2,3-dien-2-ylcyclohexene

C11H16 — CID 11994846

IUPAC1-penta-2,3-dien-2-ylcyclohexene
SMILESCC=C=C(C)C1=CCCCC1
InChIInChI=1S/C11H16/c1-3-7-10(2)11-8-5-4-6-9-11/h3,8H,4-6,9H2,1-2H3
InChIKeyNBWMHQOYAIKCER-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.61
Rot. Bonds1

About 1-penta-2,3-dien-2-ylcyclohexene

1-penta-2,3-dien-2-ylcyclohexene (PubChem CID 11994846) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 1-penta-2,3-dien-2-ylcyclohexene.

Molecular Properties

Compound Name1-penta-2,3-dien-2-ylcyclohexene
PubChem CID11994846
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name1-penta-2,3-dien-2-ylcyclohexene
SMILESCC=C=C(C)C1=CCCCC1
InChIInChI=1S/C11H16/c1-3-7-10(2)11-8-5-4-6-9-11/h3,8H,4-6,9H2,1-2H3
InChIKeyNBWMHQOYAIKCER-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Terpinolene
CID 11463
Alpha-Terpinene
CID 7462
Vinylcyclohexene
CID 17497
gamma-Bisabolene
CID 62346
gamma-BISABOLENE, (E)-
CID 5352437
1-Ethylcyclohexene
CID 73937
4-Propyl-3-heptene
CID 138270
gamma-Bisabolene, (Z)-
CID 3033866
p-Mentha-1,3,8-triene
CID 176983
(2Z)-3-Methyl-4-methylideneoct-2-ene
CID 121232770
Sylveterpinolene
CID 524200
p-Mentha-3,8-diene
CID 521851

Frequently Asked Questions

What is the IUPAC name of 1-penta-2,3-dien-2-ylcyclohexene?
The IUPAC name of 1-penta-2,3-dien-2-ylcyclohexene (CID 11994846) is 1-penta-2,3-dien-2-ylcyclohexene.
What is the SMILES notation for 1-penta-2,3-dien-2-ylcyclohexene?
The canonical SMILES for 1-penta-2,3-dien-2-ylcyclohexene is CC=C=C(C)C1=CCCCC1.
What is the InChIKey of 1-penta-2,3-dien-2-ylcyclohexene?
The InChIKey is NBWMHQOYAIKCER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-3-7-10(2)11-8-5-4-6-9-11/h3,8H,4-6,9H2,1-2H3.
What are the key properties of 1-penta-2,3-dien-2-ylcyclohexene?
1-penta-2,3-dien-2-ylcyclohexene has a molecular weight of 148.25 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-penta-2,3-dien-2-ylcyclohexene is sourced from PubChem (CID 11994846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).