2-pent-4-enylcyclohexan-1-ol

C11H20O — CID 59087603

IUPAC2-pent-4-enylcyclohexan-1-ol
SMILESC=CCCCC1CCCCC1O
InChIInChI=1S/C11H20O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h2,10-12H,1,3-9H2
InChIKeyYVFTZELTJGOARV-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.89
Rot. Bonds4

About 2-pent-4-enylcyclohexan-1-ol

2-pent-4-enylcyclohexan-1-ol (PubChem CID 59087603) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-pent-4-enylcyclohexan-1-ol.

Molecular Properties

Compound Name2-pent-4-enylcyclohexan-1-ol
PubChem CID59087603
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2-pent-4-enylcyclohexan-1-ol
SMILESC=CCCCC1CCCCC1O
InChIInChI=1S/C11H20O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h2,10-12H,1,3-9H2
InChIKeyYVFTZELTJGOARV-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2-pent-4-enylcyclohexyl)methanamine
CID 81010677
(2-hept-6-enylcyclohexyl)methanamine
CID 107010667
cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
CID 71357650
2-hept-6-enylcyclohexane-1-carboxylic acid
CID 107010655
2-hept-6-enylcycloheptane-1-carboxylic acid
CID 107010657
N-[(2-pent-4-enylcyclohexyl)methyl]propan-1-amine
CID 81027900
(1R)-2-propylcyclohexan-1-ol
CID 144627240
N-[2-[(1S,2R)-2-hydroxycyclohexyl]ethyl]prop-2-enamide
CID 166415844
hex-5-enylcyclopentane
CID 20565123
cis-(1S,2S)-2-hexylcyclopentan-1-ol
CID 10654739
trans-(1R,2S)-2-hexylcyclopentan-1-ol
CID 10797255
2-oxo-7-pent-4-enylcycloheptane-1-carbonitrile
CID 72661962

Frequently Asked Questions

What is the IUPAC name of 2-pent-4-enylcyclohexan-1-ol?
The IUPAC name of 2-pent-4-enylcyclohexan-1-ol (CID 59087603) is 2-pent-4-enylcyclohexan-1-ol.
What is the SMILES notation for 2-pent-4-enylcyclohexan-1-ol?
The canonical SMILES for 2-pent-4-enylcyclohexan-1-ol is C=CCCCC1CCCCC1O.
What is the InChIKey of 2-pent-4-enylcyclohexan-1-ol?
The InChIKey is YVFTZELTJGOARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h2,10-12H,1,3-9H2.
What are the key properties of 2-pent-4-enylcyclohexan-1-ol?
2-pent-4-enylcyclohexan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pent-4-enylcyclohexan-1-ol is sourced from PubChem (CID 59087603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).