[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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Related Compounds

(5-Phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl)methanol
CID 21066379
6-phenyl-1-[(pyridin-4-yl)methyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 7064016
2-{3-Phenylpyrazolo[1,5-a]pyrimidin-6-yl}pyridine
CID 5329461
[4-[[5-(3-Propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
CID 59186268
5-[5-amino-2-[(R)-(3-fluoro-2-pyridinyl)-hydroxymethyl]-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl]-1-methylpyridin-2-one
CID 156821421
7-(Cyclopropylamino)-5-[6-(hydroxymethyl)indol-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 70692775
7-[2-(1-Imidazolyl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455594
2-[6-(4-Methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]pyridine
CID 5329459
6-(4-Benzoylphenyl)-1-(Pyridin-4-Ylmethyl)-1h-Pyrazolo[3,4-B]pyridine-4-Carboxylic Acid
CID 60196213
3-(1-Methyl-6-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)phenol
CID 46205037
2-[(1S)-2-[3-ethyl-7-[(1-oxidopyridin-1-ium-3-yl)methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]cyclohexyl]ethanol
CID 168269482
2-(Methoxymethyl)-3,6-diphenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 2236969

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).