[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol

C19H16N4O — CID 71602073

IUPAC[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol
SMILESOCc1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C19H16N4O/c24-13-16-10-18(15-4-2-1-3-5-15)22-19-17(16)11-21-23(19)12-14-6-8-20-9-7-14/h1-11,24H,12-13H2
InChIKeyBVDWAKQGKDIXNR-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.03
Rot. Bonds4

About [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol

[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol (PubChem CID 71602073) has the molecular formula C19H16N4O and a molecular weight of 316.36 g/mol. Its IUPAC name is [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol.

Molecular Properties

Compound Name[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol
PubChem CID71602073
Molecular FormulaC19H16N4O
Molecular Weight316.36 g/mol
Exact Mass316.13
IUPAC Name[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol
SMILESOCc1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C19H16N4O/c24-13-16-10-18(15-4-2-1-3-5-15)22-19-17(16)11-21-23(19)12-14-6-8-20-9-7-14/h1-11,24H,12-13H2
InChIKeyBVDWAKQGKDIXNR-UHFFFAOYSA-N
XLogP3.03
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol?
The IUPAC name of [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol (CID 71602073) is [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol.
What is the SMILES notation for [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol?
The canonical SMILES for [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol is OCc1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1.
What is the InChIKey of [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol?
The InChIKey is BVDWAKQGKDIXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O/c24-13-16-10-18(15-4-2-1-3-5-15)22-19-17(16)11-21-23(19)12-14-6-8-20-9-7-14/h1-11,24H,12-13H2.
What are the key properties of [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol?
[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol has a molecular weight of 316.36 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol is sourced from PubChem (CID 71602073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).