1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol

C12H17NO2 — CID 62606205

IUPAC1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol
SMILESOC(Cc1ccncc1)CC1CCCO1
InChIInChI=1S/C12H17NO2/c14-11(9-12-2-1-7-15-12)8-10-3-5-13-6-4-10/h3-6,11-12,14H,1-2,7-9H2
InChIKeyJZICUIYEQGNXEI-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.55
Rot. Bonds4

About 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol

1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol (PubChem CID 62606205) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol
PubChem CID62606205
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol
SMILESOC(Cc1ccncc1)CC1CCCO1
InChIInChI=1S/C12H17NO2/c14-11(9-12-2-1-7-15-12)8-10-3-5-13-6-4-10/h3-6,11-12,14H,1-2,7-9H2
InChIKeyJZICUIYEQGNXEI-UHFFFAOYSA-N
XLogP1.55
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromophenyl)-3-(oxolan-2-yl)propan-2-ol
CID 60798546
[1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105198717
1-(oxan-2-yl)-3-pyridin-3-ylpropan-2-ol
CID 104736205
1-cyclobutyl-3-pyridin-4-ylpropan-2-ol
CID 65457180
5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine
CID 65164603
1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanol
CID 66271830
4-(oxolan-2-yl)-1-phenylbutan-2-ol
CID 65162186
1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-one
CID 62622674
1-(3-fluoro-4-pyridinyl)-2-(oxolan-2-yl)ethanol
CID 104737979
1-(2-chloro-4-fluorophenyl)-3-(oxolan-2-yl)propan-2-ol
CID 62607059
1-(1-ethylpyrazol-4-yl)-3-(oxan-2-yl)propan-2-ol
CID 113391342
N-(oxolan-2-ylmethyl)-2-phenyl-3-pyridin-4-ylpropanamide
CID 110407872

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol?
The IUPAC name of 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol (CID 62606205) is 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol.
What is the SMILES notation for 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol?
The canonical SMILES for 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol is OC(Cc1ccncc1)CC1CCCO1.
What is the InChIKey of 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol?
The InChIKey is JZICUIYEQGNXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c14-11(9-12-2-1-7-15-12)8-10-3-5-13-6-4-10/h3-6,11-12,14H,1-2,7-9H2.
What are the key properties of 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol?
1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol has a molecular weight of 207.27 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-3-pyridin-4-ylpropan-2-ol is sourced from PubChem (CID 62606205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).