(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol

C9H8FN3O — CID 105383202

IUPAC(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2cccn2)c1F
InChIInChI=1S/C9H8FN3O/c10-8-7(6-14)2-4-11-9(8)13-5-1-3-12-13/h1-5,14H,6H2
InChIKeyOUDLQCLBIXCNCA-UHFFFAOYSA-N
MW193.18 g/mol
LogP0.90
Rot. Bonds2

About (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol

(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol (PubChem CID 105383202) has the molecular formula C9H8FN3O and a molecular weight of 193.18 g/mol. Its IUPAC name is (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol
PubChem CID105383202
Molecular FormulaC9H8FN3O
Molecular Weight193.18 g/mol
Exact Mass193.07
IUPAC Name(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2cccn2)c1F
InChIInChI=1S/C9H8FN3O/c10-8-7(6-14)2-4-11-9(8)13-5-1-3-12-13/h1-5,14H,6H2
InChIKeyOUDLQCLBIXCNCA-UHFFFAOYSA-N
XLogP0.90
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol?
The IUPAC name of (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol (CID 105383202) is (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol.
What is the SMILES notation for (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol?
The canonical SMILES for (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol is OCc1ccnc(-n2cccn2)c1F.
What is the InChIKey of (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol?
The InChIKey is OUDLQCLBIXCNCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O/c10-8-7(6-14)2-4-11-9(8)13-5-1-3-12-13/h1-5,14H,6H2.
What are the key properties of (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol?
(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol has a molecular weight of 193.18 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol is sourced from PubChem (CID 105383202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).