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

C9H9N3O — CID 61256684

IUPAC(2-pyrazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2cccn2)c1
InChIInChI=1S/C9H9N3O/c13-7-8-2-4-10-9(6-8)12-5-1-3-11-12/h1-6,13H,7H2
InChIKeyOAHPRICBVQCCDB-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.76
Rot. Bonds2

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

(2-pyrazol-1-yl-4-pyridinyl)methanol (PubChem CID 61256684) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is (2-pyrazol-1-yl-4-pyridinyl)methanol.

Molecular Properties

Compound Name(2-pyrazol-1-yl-4-pyridinyl)methanol
PubChem CID61256684
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name(2-pyrazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2cccn2)c1
InChIInChI=1S/C9H9N3O/c13-7-8-2-4-10-9(6-8)12-5-1-3-11-12/h1-6,13H,7H2
InChIKeyOAHPRICBVQCCDB-UHFFFAOYSA-N
XLogP0.76
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-pyrazol-1-yl-4-pyridinyl)methanol?
The IUPAC name of (2-pyrazol-1-yl-4-pyridinyl)methanol (CID 61256684) is (2-pyrazol-1-yl-4-pyridinyl)methanol.
What is the SMILES notation for (2-pyrazol-1-yl-4-pyridinyl)methanol?
The canonical SMILES for (2-pyrazol-1-yl-4-pyridinyl)methanol is OCc1ccnc(-n2cccn2)c1.
What is the InChIKey of (2-pyrazol-1-yl-4-pyridinyl)methanol?
The InChIKey is OAHPRICBVQCCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c13-7-8-2-4-10-9(6-8)12-5-1-3-11-12/h1-6,13H,7H2.
What are the key properties of (2-pyrazol-1-yl-4-pyridinyl)methanol?
(2-pyrazol-1-yl-4-pyridinyl)methanol has a molecular weight of 175.19 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyrazol-1-yl-4-pyridinyl)methanol is sourced from PubChem (CID 61256684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).