pyridin-3-yl(pyrimidin-2-yl)methanol

C10H9N3O — CID 54244340

IUPACpyridin-3-yl(pyrimidin-2-yl)methanol
SMILESOC(c1cccnc1)c1ncccn1
InChIInChI=1S/C10H9N3O/c14-9(8-3-1-4-11-7-8)10-12-5-2-6-13-10/h1-7,9,14H
InChIKeyQSEKXZLEJSPPMV-UHFFFAOYSA-N
MW187.20 g/mol
LogP0.95
Rot. Bonds2

About pyridin-3-yl(pyrimidin-2-yl)methanol

pyridin-3-yl(pyrimidin-2-yl)methanol (PubChem CID 54244340) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is pyridin-3-yl(pyrimidin-2-yl)methanol.

Molecular Properties

Compound Namepyridin-3-yl(pyrimidin-2-yl)methanol
PubChem CID54244340
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Namepyridin-3-yl(pyrimidin-2-yl)methanol
SMILESOC(c1cccnc1)c1ncccn1
InChIInChI=1S/C10H9N3O/c14-9(8-3-1-4-11-7-8)10-12-5-2-6-13-10/h1-7,9,14H
InChIKeyQSEKXZLEJSPPMV-UHFFFAOYSA-N
XLogP0.95
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 ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-pyridin-2-yl(pyridin-3-yl)methanol
CID 86315351
(R)-(2-fluoro-3-pyridinyl)-pyridin-3-ylmethanol
CID 86334771
(2-methyltetrazol-5-yl)-pyridin-3-ylmethanol
CID 131137701
(3,5-dichlorophenyl)-pyridin-3-ylmethanol
CID 63900537
1,2-oxazol-4-yl(pyridin-3-yl)methanol
CID 91481512
(2-cyclopropylphenyl)-pyridin-3-ylmethanol
CID 79982582
(2R)-3-pyridin-3-ylbutan-2-ol
CID 57231816
(S)-[4-(dimethylamino)phenyl]-pyridin-3-ylmethanol
CID 129369618
(R)-(5-methylfuran-2-yl)-pyridin-3-ylmethanol
CID 681019
5-chloro-7-[hydroxy(pyridin-3-yl)methyl]quinolin-8-ol
CID 146026296
3-[hydroxy(pyridin-3-yl)methyl]benzonitrile
CID 14989408
2-[hydroxy(pyridin-3-yl)methyl]benzonitrile
CID 69484555

Frequently Asked Questions

What is the IUPAC name of pyridin-3-yl(pyrimidin-2-yl)methanol?
The IUPAC name of pyridin-3-yl(pyrimidin-2-yl)methanol (CID 54244340) is pyridin-3-yl(pyrimidin-2-yl)methanol.
What is the SMILES notation for pyridin-3-yl(pyrimidin-2-yl)methanol?
The canonical SMILES for pyridin-3-yl(pyrimidin-2-yl)methanol is OC(c1cccnc1)c1ncccn1.
What is the InChIKey of pyridin-3-yl(pyrimidin-2-yl)methanol?
The InChIKey is QSEKXZLEJSPPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c14-9(8-3-1-4-11-7-8)10-12-5-2-6-13-10/h1-7,9,14H.
What are the key properties of pyridin-3-yl(pyrimidin-2-yl)methanol?
pyridin-3-yl(pyrimidin-2-yl)methanol has a molecular weight of 187.20 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-yl(pyrimidin-2-yl)methanol is sourced from PubChem (CID 54244340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).