3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol

C11H17NO2 — CID 40787531

IUPAC3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol
SMILESOCCCc1cccc(CCCO)n1
InChIInChI=1S/C11H17NO2/c13-8-2-6-10-4-1-5-11(12-10)7-3-9-14/h1,4-5,13-14H,2-3,6-9H2
InChIKeyGVIZSPVYUCBWKE-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.93
Rot. Bonds6

About 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol

3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol (PubChem CID 40787531) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol
PubChem CID40787531
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol
SMILESOCCCc1cccc(CCCO)n1
InChIInChI=1S/C11H17NO2/c13-8-2-6-10-4-1-5-11(12-10)7-3-9-14/h1,4-5,13-14H,2-3,6-9H2
InChIKeyGVIZSPVYUCBWKE-UHFFFAOYSA-N
XLogP0.93
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol?
The IUPAC name of 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol (CID 40787531) is 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol is OCCCc1cccc(CCCO)n1.
What is the InChIKey of 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol?
The InChIKey is GVIZSPVYUCBWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c13-8-2-6-10-4-1-5-11(12-10)7-3-9-14/h1,4-5,13-14H,2-3,6-9H2.
What are the key properties of 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol?
3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol has a molecular weight of 195.26 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(3-hydroxypropyl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 40787531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).