1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one

C14H13N3O2 — CID 155547235

IUPAC1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one
SMILESCOc1cccc(-n2ncc3c(=O)[nH]c(C)cc32)c1
InChIInChI=1S/C14H13N3O2/c1-9-6-13-12(14(18)16-9)8-15-17(13)10-4-3-5-11(7-10)19-2/h3-8H,1-2H3,(H,16,18)
InChIKeyNJXAYYWZDZPGQH-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.03
Rot. Bonds2

About 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one

1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one (PubChem CID 155547235) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one
PubChem CID155547235
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one
SMILESCOc1cccc(-n2ncc3c(=O)[nH]c(C)cc32)c1
InChIInChI=1S/C14H13N3O2/c1-9-6-13-12(14(18)16-9)8-15-17(13)10-4-3-5-11(7-10)19-2/h3-8H,1-2H3,(H,16,18)
InChIKeyNJXAYYWZDZPGQH-UHFFFAOYSA-N
XLogP2.03
TPSA59.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 5297391
N-(4-methoxyphenyl)-5-methyl-1-phenylpyrazole-4-carboxamide
CID 850331
N-(3-methoxyphenyl)-5-methyl-1-phenyl-1H-pyrazole-4-carboxamide
CID 850352
N-(2,4-dimethoxyphenyl)-5-methyl-1-phenyl-1H-pyrazole-4-carboxamide
CID 850902
N'-(2-methoxyphenyl)-1-phenyl-5-propyl-1H-pyrazole-4-carbohydrazide
CID 2812503
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-4-pyrazolecarboxamide
CID 5301257
N-(3-methoxyphenyl)-1-methyl-1H-pyrazole-3-carboxamide
CID 903366
1-ethyl-N-(2-methoxy-4-nitrophenyl)-5-methylpyrazole-4-carboxamide
CID 4343678
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-1H-pyrazole-4-carboxamide
CID 4464934
5-Methyl-1-phenyl-4-pyrazolecarboxylic acid (4-methoxyphenyl) ester
CID 850682
1-(2-ethylphenyl)-N-(4-methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 1235420
5-chloro-N-(3-methoxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide
CID 2243676

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The IUPAC name of 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one (CID 155547235) is 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one.
What is the SMILES notation for 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The canonical SMILES for 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one is COc1cccc(-n2ncc3c(=O)[nH]c(C)cc32)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The InChIKey is NJXAYYWZDZPGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-9-6-13-12(14(18)16-9)8-15-17(13)10-4-3-5-11(7-10)19-2/h3-8H,1-2H3,(H,16,18).
What are the key properties of 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one?
1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one has a molecular weight of 255.28 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-6-methyl-5H-pyrazolo[4,5-c]pyridin-4-one is sourced from PubChem (CID 155547235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).