tripyridin-3-ylmethanol

C16H13N3O — CID 177395677

IUPACtripyridin-3-ylmethanol
SMILESOC(c1cccnc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C16H13N3O/c20-16(13-4-1-7-17-10-13,14-5-2-8-18-11-14)15-6-3-9-19-12-15/h1-12,20H
InChIKeyLKOYATDJPPTINV-UHFFFAOYSA-N
MW263.30 g/mol
LogP2.16
Rot. Bonds3

About tripyridin-3-ylmethanol

tripyridin-3-ylmethanol (PubChem CID 177395677) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is tripyridin-3-ylmethanol.

Molecular Properties

Compound Nametripyridin-3-ylmethanol
PubChem CID177395677
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Nametripyridin-3-ylmethanol
SMILESOC(c1cccnc1)(c1cccnc1)c1cccnc1
InChIInChI=1S/C16H13N3O/c20-16(13-4-1-7-17-10-13,14-5-2-8-18-11-14)15-6-3-9-19-12-15/h1-12,20H
InChIKeyLKOYATDJPPTINV-UHFFFAOYSA-N
XLogP2.16
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(hydroxy-phenyl-pyridin-3-ylmethyl)phenol
CID 91752041
6-(hydroxy-phenyl-pyridin-3-ylmethyl)naphthalen-2-ol
CID 67931636
2,4-dimethyl-4-pyridin-3-ylpentan-2-ol
CID 145044151
(2R)-1,1,1-trifluoro-2-pyridin-3-ylpropan-2-ol
CID 7053126
3-methyl-2-pyridin-3-ylbutan-2-ol
CID 58641587
1,1,1-trifluoro-2-pyridin-3-ylpropan-2-ol
CID 2748409
bis(4-chloro-2-fluorophenyl)-pyridin-3-ylmethanol
CID 56682755
2,8-dimethyl-5-pyridin-3-ylnonan-5-ol
CID 21420922
3-hydroxy-3-pyridin-3-ylbutan-2-one
CID 4912937
1-fluoro-2-pyridin-3-ylpropan-2-ol
CID 89407695
1,1,2-tripyridin-3-ylethanol
CID 57425683
(3R)-3-hydroxy-3-pyridin-3-ylbutan-2-one
CID 7200717

Frequently Asked Questions

What is the IUPAC name of tripyridin-3-ylmethanol?
The IUPAC name of tripyridin-3-ylmethanol (CID 177395677) is tripyridin-3-ylmethanol.
What is the SMILES notation for tripyridin-3-ylmethanol?
The canonical SMILES for tripyridin-3-ylmethanol is OC(c1cccnc1)(c1cccnc1)c1cccnc1.
What is the InChIKey of tripyridin-3-ylmethanol?
The InChIKey is LKOYATDJPPTINV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c20-16(13-4-1-7-17-10-13,14-5-2-8-18-11-14)15-6-3-9-19-12-15/h1-12,20H.
What are the key properties of tripyridin-3-ylmethanol?
tripyridin-3-ylmethanol has a molecular weight of 263.30 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tripyridin-3-ylmethanol is sourced from PubChem (CID 177395677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).