[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol

C9H7ClFN3O — CID 105383210

IUPAC[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol
SMILESOCc1ccnc(-n2cc(Cl)cn2)c1F
InChIInChI=1S/C9H7ClFN3O/c10-7-3-13-14(4-7)9-8(11)6(5-15)1-2-12-9/h1-4,15H,5H2
InChIKeyDCIJMPRQICRSDT-UHFFFAOYSA-N
MW227.63 g/mol
LogP1.55
Rot. Bonds2

About [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol

[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol (PubChem CID 105383210) has the molecular formula C9H7ClFN3O and a molecular weight of 227.63 g/mol. Its IUPAC name is [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol
PubChem CID105383210
Molecular FormulaC9H7ClFN3O
Molecular Weight227.63 g/mol
Exact Mass227.03
IUPAC Name[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol
SMILESOCc1ccnc(-n2cc(Cl)cn2)c1F
InChIInChI=1S/C9H7ClFN3O/c10-7-3-13-14(4-7)9-8(11)6(5-15)1-2-12-9/h1-4,15H,5H2
InChIKeyDCIJMPRQICRSDT-UHFFFAOYSA-N
XLogP1.55
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.63
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)methanol
CID 105383202
[2-(4-chloropyrazol-1-yl)phenyl]methanol
CID 61035792
(3-fluoro-2-thiomorpholin-4-yl-4-pyridinyl)methanol
CID 105382896
[4-(4-chloropyrazol-1-yl)-3-fluorophenyl]methanol
CID 61035650
[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol
CID 61255001
[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol
CID 105383215
1-[3-(4-chloropyrazol-1-yl)pyrazin-2-yl]ethanol
CID 167322980
[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol
CID 118813716
[3-(4-chloropyrazol-1-yl)-5-fluorophenyl]methanol
CID 106530074
[3-fluoro-2-(1,4-thiazepan-4-yl)-4-pyridinyl]methanol
CID 105382959
4-(chloromethyl)-3-(4-chloropyrazol-1-yl)pyridine
CID 105067554
(6-chloropyrazolo[1,5-a]pyrimidin-3-yl)methanol
CID 133058331

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The IUPAC name of [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol (CID 105383210) is [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol.
What is the SMILES notation for [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The canonical SMILES for [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol is OCc1ccnc(-n2cc(Cl)cn2)c1F.
What is the InChIKey of [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The InChIKey is DCIJMPRQICRSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClFN3O/c10-7-3-13-14(4-7)9-8(11)6(5-15)1-2-12-9/h1-4,15H,5H2.
What are the key properties of [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
[2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol has a molecular weight of 227.63 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloropyrazol-1-yl)-3-fluoro-4-pyridinyl]methanol is sourced from PubChem (CID 105383210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).