(4-pyridin-2-ylpyrimidin-2-yl)methanol

C10H9N3O — CID 116899498

IUPAC(4-pyridin-2-ylpyrimidin-2-yl)methanol
SMILESOCc1nccc(-c2ccccn2)n1
InChIInChI=1S/C10H9N3O/c14-7-10-12-6-4-9(13-10)8-3-1-2-5-11-8/h1-6,14H,7H2
InChIKeyQFIXZUZISKKFGX-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.03
Rot. Bonds2

About (4-pyridin-2-ylpyrimidin-2-yl)methanol

(4-pyridin-2-ylpyrimidin-2-yl)methanol (PubChem CID 116899498) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is (4-pyridin-2-ylpyrimidin-2-yl)methanol.

Molecular Properties

Compound Name(4-pyridin-2-ylpyrimidin-2-yl)methanol
PubChem CID116899498
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name(4-pyridin-2-ylpyrimidin-2-yl)methanol
SMILESOCc1nccc(-c2ccccn2)n1
InChIInChI=1S/C10H9N3O/c14-7-10-12-6-4-9(13-10)8-3-1-2-5-11-8/h1-6,14H,7H2
InChIKeyQFIXZUZISKKFGX-UHFFFAOYSA-N
XLogP1.03
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-pyridin-2-ylpyrimidin-2-yl)methanol?
The IUPAC name of (4-pyridin-2-ylpyrimidin-2-yl)methanol (CID 116899498) is (4-pyridin-2-ylpyrimidin-2-yl)methanol.
What is the SMILES notation for (4-pyridin-2-ylpyrimidin-2-yl)methanol?
The canonical SMILES for (4-pyridin-2-ylpyrimidin-2-yl)methanol is OCc1nccc(-c2ccccn2)n1.
What is the InChIKey of (4-pyridin-2-ylpyrimidin-2-yl)methanol?
The InChIKey is QFIXZUZISKKFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c14-7-10-12-6-4-9(13-10)8-3-1-2-5-11-8/h1-6,14H,7H2.
What are the key properties of (4-pyridin-2-ylpyrimidin-2-yl)methanol?
(4-pyridin-2-ylpyrimidin-2-yl)methanol has a molecular weight of 187.20 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyridin-2-ylpyrimidin-2-yl)methanol is sourced from PubChem (CID 116899498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).