2-(cyclohexen-1-yl)pent-1-en-3-ol

C11H18O — CID 101439929

IUPAC2-(cyclohexen-1-yl)pent-1-en-3-ol
SMILESC=C(C1=CCCCC1)C(O)CC
InChIInChI=1S/C11H18O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h7,11-12H,2-6,8H2,1H3
InChIKeyULXPTAIGJDQFRM-UHFFFAOYSA-N
MW166.26 g/mol
LogP2.81
Rot. Bonds3

About 2-(cyclohexen-1-yl)pent-1-en-3-ol

2-(cyclohexen-1-yl)pent-1-en-3-ol (PubChem CID 101439929) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)pent-1-en-3-ol.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)pent-1-en-3-ol
PubChem CID101439929
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name2-(cyclohexen-1-yl)pent-1-en-3-ol
SMILESC=C(C1=CCCCC1)C(O)CC
InChIInChI=1S/C11H18O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h7,11-12H,2-6,8H2,1H3
InChIKeyULXPTAIGJDQFRM-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)pent-1-en-3-ol?
The IUPAC name of 2-(cyclohexen-1-yl)pent-1-en-3-ol (CID 101439929) is 2-(cyclohexen-1-yl)pent-1-en-3-ol.
What is the SMILES notation for 2-(cyclohexen-1-yl)pent-1-en-3-ol?
The canonical SMILES for 2-(cyclohexen-1-yl)pent-1-en-3-ol is C=C(C1=CCCCC1)C(O)CC.
What is the InChIKey of 2-(cyclohexen-1-yl)pent-1-en-3-ol?
The InChIKey is ULXPTAIGJDQFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h7,11-12H,2-6,8H2,1H3.
What are the key properties of 2-(cyclohexen-1-yl)pent-1-en-3-ol?
2-(cyclohexen-1-yl)pent-1-en-3-ol has a molecular weight of 166.26 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)pent-1-en-3-ol is sourced from PubChem (CID 101439929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).