6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one

C19H20N4O2 — CID 156806650

IUPAC6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
SMILESCOc1ccc(CN2CCc3c([nH]n(-c4ccccn4)c3=O)C2)cc1
InChIInChI=1S/C19H20N4O2/c1-25-15-7-5-14(6-8-15)12-22-11-9-16-17(13-22)21-23(19(16)24)18-4-2-3-10-20-18/h2-8,10,21H,9,11-13H2,1H3
InChIKeyUYSPRTPKTLQAHS-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.13
Rot. Bonds4

About 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one

6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one (PubChem CID 156806650) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one.

Molecular Properties

Compound Name6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
PubChem CID156806650
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
SMILESCOc1ccc(CN2CCc3c([nH]n(-c4ccccn4)c3=O)C2)cc1
InChIInChI=1S/C19H20N4O2/c1-25-15-7-5-14(6-8-15)12-22-11-9-16-17(13-22)21-23(19(16)24)18-4-2-3-10-20-18/h2-8,10,21H,9,11-13H2,1H3
InChIKeyUYSPRTPKTLQAHS-UHFFFAOYSA-N
XLogP2.13
TPSA63.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one with MolForge

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Related Compounds

3-oxo-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridine-6-carboxylic acid
CID 175289153
2-benzyl-5-[(4-methoxyphenyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-one
CID 53357548
5-[4-(4-methoxyphenyl)piperazin-1-yl]-2-pyridin-2-yl-4,5,6,7-tetrahydro-1H-indazol-3-one
CID 164909597
2-benzyl-6-(pyridin-2-ylmethyl)-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
CID 67373358
4-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
CID 175782485
2-(3-methoxyphenyl)-5-[(4-phenylmethoxyphenyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-one
CID 53357675
2,6-dibenzyl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
CID 67373232
6-[(4-chlorophenyl)methyl]-2-[(3-methoxyphenyl)methyl]-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
CID 67374450
4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-phenyl-3,6-dihydro-2H-pyridine
CID 102519654
6-[(3-chlorophenyl)methyl]-2-[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridinyl]-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
CID 67355726
2-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-one
CID 67372261
2-benzyl-6-[(4-chlorophenyl)methyl]-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one
CID 67375523

Frequently Asked Questions

What is the IUPAC name of 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one?
The IUPAC name of 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one (CID 156806650) is 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one.
What is the SMILES notation for 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one?
The canonical SMILES for 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one is COc1ccc(CN2CCc3c([nH]n(-c4ccccn4)c3=O)C2)cc1.
What is the InChIKey of 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one?
The InChIKey is UYSPRTPKTLQAHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-15-7-5-14(6-8-15)12-22-11-9-16-17(13-22)21-23(19(16)24)18-4-2-3-10-20-18/h2-8,10,21H,9,11-13H2,1H3.
What are the key properties of 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one?
6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one has a molecular weight of 336.40 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-one is sourced from PubChem (CID 156806650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).