[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol

C16H14FN3O — CID 66633410

IUPAC[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol
SMILESOCc1cc(-c2ccccn2)nn1Cc1ccccc1F
InChIInChI=1S/C16H14FN3O/c17-14-6-2-1-5-12(14)10-20-13(11-21)9-16(19-20)15-7-3-4-8-18-15/h1-9,21H,10-11H2
InChIKeyRFNHYIMCDJLDMJ-UHFFFAOYSA-N
MW283.31 g/mol
LogP2.62
Rot. Bonds4

About [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol

[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol (PubChem CID 66633410) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol.

Molecular Properties

Compound Name[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol
PubChem CID66633410
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol
SMILESOCc1cc(-c2ccccn2)nn1Cc1ccccc1F
InChIInChI=1S/C16H14FN3O/c17-14-6-2-1-5-12(14)10-20-13(11-21)9-16(19-20)15-7-3-4-8-18-15/h1-9,21H,10-11H2
InChIKeyRFNHYIMCDJLDMJ-UHFFFAOYSA-N
XLogP2.62
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol?
The IUPAC name of [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol (CID 66633410) is [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol.
What is the SMILES notation for [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol?
The canonical SMILES for [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol is OCc1cc(-c2ccccn2)nn1Cc1ccccc1F.
What is the InChIKey of [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol?
The InChIKey is RFNHYIMCDJLDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c17-14-6-2-1-5-12(14)10-20-13(11-21)9-16(19-20)15-7-3-4-8-18-15/h1-9,21H,10-11H2.
What are the key properties of [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol?
[1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol has a molecular weight of 283.31 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpyrazol-5-yl]methanol is sourced from PubChem (CID 66633410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).