(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol

C15H13F2NO3 — CID 23114679

IUPAC(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol
SMILESOC(c1ccc(C2OCCO2)cn1)c1cc(F)ccc1F
InChIInChI=1S/C15H13F2NO3/c16-10-2-3-12(17)11(7-10)14(19)13-4-1-9(8-18-13)15-20-5-6-21-15/h1-4,7-8,14-15,19H,5-6H2
InChIKeyLSWSXNOYPXMCSC-UHFFFAOYSA-N
MW293.27 g/mol
LogP2.49
Rot. Bonds3

About (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol

(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol (PubChem CID 23114679) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol
PubChem CID23114679
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC Name(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol
SMILESOC(c1ccc(C2OCCO2)cn1)c1cc(F)ccc1F
InChIInChI=1S/C15H13F2NO3/c16-10-2-3-12(17)11(7-10)14(19)13-4-1-9(8-18-13)15-20-5-6-21-15/h1-4,7-8,14-15,19H,5-6H2
InChIKeyLSWSXNOYPXMCSC-UHFFFAOYSA-N
XLogP2.49
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol 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 (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol?
The IUPAC name of (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol (CID 23114679) is (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol.
What is the SMILES notation for (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol?
The canonical SMILES for (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol is OC(c1ccc(C2OCCO2)cn1)c1cc(F)ccc1F.
What is the InChIKey of (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol?
The InChIKey is LSWSXNOYPXMCSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c16-10-2-3-12(17)11(7-10)14(19)13-4-1-9(8-18-13)15-20-5-6-21-15/h1-4,7-8,14-15,19H,5-6H2.
What are the key properties of (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol?
(2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol has a molecular weight of 293.27 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-[5-(1,3-dioxolan-2-yl)-2-pyridinyl]methanol is sourced from PubChem (CID 23114679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).