[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol

C14H13N3O — CID 90133560

IUPAC[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol
SMILESOCc1ccc2cnn(Cc3cccnc3)c2c1
InChIInChI=1S/C14H13N3O/c18-10-11-3-4-13-8-16-17(14(13)6-11)9-12-2-1-5-15-7-12/h1-8,18H,9-10H2
InChIKeyJKRJBOYZFQLEGT-UHFFFAOYSA-N
MW239.28 g/mol
LogP1.97
Rot. Bonds3

About [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol

[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol (PubChem CID 90133560) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol.

Molecular Properties

Compound Name[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol
PubChem CID90133560
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol
SMILESOCc1ccc2cnn(Cc3cccnc3)c2c1
InChIInChI=1S/C14H13N3O/c18-10-11-3-4-13-8-16-17(14(13)6-11)9-12-2-1-5-15-7-12/h1-8,18H,9-10H2
InChIKeyJKRJBOYZFQLEGT-UHFFFAOYSA-N
XLogP1.97
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol?
The IUPAC name of [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol (CID 90133560) is [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol.
What is the SMILES notation for [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol?
The canonical SMILES for [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol is OCc1ccc2cnn(Cc3cccnc3)c2c1.
What is the InChIKey of [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol?
The InChIKey is JKRJBOYZFQLEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c18-10-11-3-4-13-8-16-17(14(13)6-11)9-12-2-1-5-15-7-12/h1-8,18H,9-10H2.
What are the key properties of [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol?
[1-(pyridin-3-ylmethyl)indazol-6-yl]methanol has a molecular weight of 239.28 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyridin-3-ylmethyl)indazol-6-yl]methanol is sourced from PubChem (CID 90133560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).