(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone

C20H15N3O2 — CID 1211941

IUPAC(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone
SMILESCc1nn(-c2ccccc2)c2ncc(C(=O)c3ccccc3O)cc12
InChIInChI=1S/C20H15N3O2/c1-13-17-11-14(19(25)16-9-5-6-10-18(16)24)12-21-20(17)23(22-13)15-7-3-2-4-8-15/h2-12,24H,1H3
InChIKeyHAKMOWZBKMIOJH-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.67
Rot. Bonds3

About (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone

(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone (PubChem CID 1211941) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone
PubChem CID1211941
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC Name(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone
SMILESCc1nn(-c2ccccc2)c2ncc(C(=O)c3ccccc3O)cc12
InChIInChI=1S/C20H15N3O2/c1-13-17-11-14(19(25)16-9-5-6-10-18(16)24)12-21-20(17)23(22-13)15-7-3-2-4-8-15/h2-12,24H,1H3
InChIKeyHAKMOWZBKMIOJH-UHFFFAOYSA-N
XLogP3.67
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Ethyl 4-(4-hydroxyanilino)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 11406597
Ethyl 4-(4-hydroxyanilino)-1,3-diphenylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 11476465
(2-hydroxyphenyl)[3-methyl-1-(pyridin-2-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl]methanone
CID 16259746
(1,3-Dimethylpyrazolo[3,4-b]pyridin-5-yl)-(2-hydroxyphenyl)methanone
CID 2125445
(1,3-Dimethylpyrazolo[3,4-b]pyridin-5-yl)-(2-hydroxy-5-methylphenyl)methanone
CID 4884002
(5-Fluoro-2-hydroxyphenyl)-[1-(2-hydroxyethyl)-3-methylpyrazolo[3,4-b]pyridin-5-yl]methanone
CID 4884014
(2-hydroxy-5-methylphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 901814
(5-chloro-2-hydroxyphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 1211939
(5-fluoro-2-hydroxyphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 4884005
Ethyl 4-[3-(diethylaminomethyl)-4-hydroxyanilino]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 6918789
Ethyl 4-[3-(diethylaminomethyl)-4-hydroxyanilino]-1,3-diphenylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 6918790
(5-fluoro-2-hydroxyphenyl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 2094064

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone?
The IUPAC name of (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone (CID 1211941) is (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone.
What is the SMILES notation for (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone?
The canonical SMILES for (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone is Cc1nn(-c2ccccc2)c2ncc(C(=O)c3ccccc3O)cc12.
What is the InChIKey of (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone?
The InChIKey is HAKMOWZBKMIOJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c1-13-17-11-14(19(25)16-9-5-6-10-18(16)24)12-21-20(17)23(22-13)15-7-3-2-4-8-15/h2-12,24H,1H3.
What are the key properties of (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone?
(2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone has a molecular weight of 329.36 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)methanone is sourced from PubChem (CID 1211941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).