5-pyridin-3-ylpentan-1-ol

C10H15NO — CID 642810

IUPAC5-pyridin-3-ylpentan-1-ol
SMILESOCCCCCc1cccnc1
InChIInChI=1S/C10H15NO/c12-8-3-1-2-5-10-6-4-7-11-9-10/h4,6-7,9,12H,1-3,5,8H2
InChIKeyZTLBNLWBIMJSES-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.79
Rot. Bonds5

About 5-pyridin-3-ylpentan-1-ol

5-pyridin-3-ylpentan-1-ol (PubChem CID 642810) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 5-pyridin-3-ylpentan-1-ol.

Molecular Properties

Compound Name5-pyridin-3-ylpentan-1-ol
PubChem CID642810
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name5-pyridin-3-ylpentan-1-ol
SMILESOCCCCCc1cccnc1
InChIInChI=1S/C10H15NO/c12-8-3-1-2-5-10-6-4-7-11-9-10/h4,6-7,9,12H,1-3,5,8H2
InChIKeyZTLBNLWBIMJSES-UHFFFAOYSA-N
XLogP1.79
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-ylpentan-1-ol?
The IUPAC name of 5-pyridin-3-ylpentan-1-ol (CID 642810) is 5-pyridin-3-ylpentan-1-ol.
What is the SMILES notation for 5-pyridin-3-ylpentan-1-ol?
The canonical SMILES for 5-pyridin-3-ylpentan-1-ol is OCCCCCc1cccnc1.
What is the InChIKey of 5-pyridin-3-ylpentan-1-ol?
The InChIKey is ZTLBNLWBIMJSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c12-8-3-1-2-5-10-6-4-7-11-9-10/h4,6-7,9,12H,1-3,5,8H2.
What are the key properties of 5-pyridin-3-ylpentan-1-ol?
5-pyridin-3-ylpentan-1-ol has a molecular weight of 165.24 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-ylpentan-1-ol is sourced from PubChem (CID 642810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).