[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol

C9H8ClN3O — CID 61255001

IUPAC[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(-n2cc(Cl)cn2)nc1
InChIInChI=1S/C9H8ClN3O/c10-8-4-12-13(5-8)9-2-1-7(6-14)3-11-9/h1-5,14H,6H2
InChIKeyQFLLUDLEZCRHGM-UHFFFAOYSA-N
MW209.64 g/mol
LogP1.41
Rot. Bonds2

About [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol

[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol (PubChem CID 61255001) has the molecular formula C9H8ClN3O and a molecular weight of 209.64 g/mol. Its IUPAC name is [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol
PubChem CID61255001
Molecular FormulaC9H8ClN3O
Molecular Weight209.64 g/mol
Exact Mass209.04
IUPAC Name[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(-n2cc(Cl)cn2)nc1
InChIInChI=1S/C9H8ClN3O/c10-8-4-12-13(5-8)9-2-1-7(6-14)3-11-9/h1-5,14H,6H2
InChIKeyQFLLUDLEZCRHGM-UHFFFAOYSA-N
XLogP1.41
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.64
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol (CID 61255001) is [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol is OCc1ccc(-n2cc(Cl)cn2)nc1.
What is the InChIKey of [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol?
The InChIKey is QFLLUDLEZCRHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O/c10-8-4-12-13(5-8)9-2-1-7(6-14)3-11-9/h1-5,14H,6H2.
What are the key properties of [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol?
[6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol has a molecular weight of 209.64 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-chloropyrazol-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 61255001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).