[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol

C10H9FN2O — CID 164643805

IUPAC[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol
SMILESOCc1ccc(-c2ccn[nH]2)cc1F
InChIInChI=1S/C10H9FN2O/c11-9-5-7(1-2-8(9)6-14)10-3-4-12-13-10/h1-5,14H,6H2,(H,12,13)
InChIKeyIQWZXWCPDMVCAA-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.71
Rot. Bonds2

About [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol

[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol (PubChem CID 164643805) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol
PubChem CID164643805
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol
SMILESOCc1ccc(-c2ccn[nH]2)cc1F
InChIInChI=1S/C10H9FN2O/c11-9-5-7(1-2-8(9)6-14)10-3-4-12-13-10/h1-5,14H,6H2,(H,12,13)
InChIKeyIQWZXWCPDMVCAA-UHFFFAOYSA-N
XLogP1.71
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol?
The IUPAC name of [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol (CID 164643805) is [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol.
What is the SMILES notation for [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol?
The canonical SMILES for [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol is OCc1ccc(-c2ccn[nH]2)cc1F.
What is the InChIKey of [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol?
The InChIKey is IQWZXWCPDMVCAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c11-9-5-7(1-2-8(9)6-14)10-3-4-12-13-10/h1-5,14H,6H2,(H,12,13).
What are the key properties of [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol?
[2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol has a molecular weight of 192.19 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-4-(1H-pyrazol-5-yl)phenyl]methanol is sourced from PubChem (CID 164643805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).