1-cyclopentylpent-4-yn-1-ol

C10H16O — CID 63657478

IUPAC1-cyclopentylpent-4-yn-1-ol
SMILESC#CCCC(O)C1CCCC1
InChIInChI=1S/C10H16O/c1-2-3-8-10(11)9-6-4-5-7-9/h1,9-11H,3-8H2
InChIKeyBEXDZINGECSHBG-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.95
Rot. Bonds3

About 1-cyclopentylpent-4-yn-1-ol

1-cyclopentylpent-4-yn-1-ol (PubChem CID 63657478) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-cyclopentylpent-4-yn-1-ol.

Molecular Properties

Compound Name1-cyclopentylpent-4-yn-1-ol
PubChem CID63657478
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name1-cyclopentylpent-4-yn-1-ol
SMILESC#CCCC(O)C1CCCC1
InChIInChI=1S/C10H16O/c1-2-3-8-10(11)9-6-4-5-7-9/h1,9-11H,3-8H2
InChIKeyBEXDZINGECSHBG-UHFFFAOYSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-cyclohexylpent-4-yn-1-ol
CID 63657295
1-(4-propan-2-ylcyclohexyl)pent-4-yn-1-ol
CID 65423161
1-(oxan-4-yl)pent-4-yn-1-ol
CID 63901173
1-(oxan-3-yl)pent-4-yn-1-ol
CID 63901178
1-(thiolan-3-yl)pent-4-yn-1-ol
CID 105098646
1-cyclooctylpent-4-yn-1-amine
CID 80603767
1-(4-butylcyclohexyl)pent-4-yn-1-ol
CID 115799427
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-yn-1-ol
CID 112680933
1-cyclobutylhex-5-yn-2-ol
CID 103170011
1-cyclohexyl-N-methylpent-4-yn-1-amine
CID 63657872
1-cyclohexylpentane-1,4-diol
CID 11446772
(1R)-1-cyclohexylethane-1,2-diol
CID 11789331

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylpent-4-yn-1-ol?
The IUPAC name of 1-cyclopentylpent-4-yn-1-ol (CID 63657478) is 1-cyclopentylpent-4-yn-1-ol.
What is the SMILES notation for 1-cyclopentylpent-4-yn-1-ol?
The canonical SMILES for 1-cyclopentylpent-4-yn-1-ol is C#CCCC(O)C1CCCC1.
What is the InChIKey of 1-cyclopentylpent-4-yn-1-ol?
The InChIKey is BEXDZINGECSHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-2-3-8-10(11)9-6-4-5-7-9/h1,9-11H,3-8H2.
What are the key properties of 1-cyclopentylpent-4-yn-1-ol?
1-cyclopentylpent-4-yn-1-ol has a molecular weight of 152.24 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylpent-4-yn-1-ol is sourced from PubChem (CID 63657478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).