6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one

C19H18N6O2 — CID 164548836

IUPAC6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one
SMILESCOc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)nc(C)n4)cc32)c1
InChIInChI=1S/C19H18N6O2/c1-11-7-18(22-12(2)21-11)23-17-9-16-15(10-20-17)19(26)24-25(16)13-5-4-6-14(8-13)27-3/h4-10H,1-3H3,(H,24,26)(H,20,21,22,23)
InChIKeyPVWANZPOFPYQBA-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.87
Rot. Bonds4

About 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one

6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one (PubChem CID 164548836) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one.

Molecular Properties

Compound Name6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one
PubChem CID164548836
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one
SMILESCOc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)nc(C)n4)cc32)c1
InChIInChI=1S/C19H18N6O2/c1-11-7-18(22-12(2)21-11)23-17-9-16-15(10-20-17)19(26)24-25(16)13-5-4-6-14(8-13)27-3/h4-10H,1-3H3,(H,24,26)(H,20,21,22,23)
InChIKeyPVWANZPOFPYQBA-UHFFFAOYSA-N
XLogP2.87
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one with MolForge

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Related Compounds

6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-[2-methoxy-3-(trifluoromethyl)phenyl]-2H-pyrazolo[4,3-c]pyridin-3-one
CID 164548837
6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(4-methylsulfonylphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one
CID 164548936
2-(3-methoxyphenyl)-7-methyl-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one
CID 134508221
2-(3-methoxyphenyl)-3-phenyl-1H-1,2,4-triazol-5-one
CID 54063244
6-(3-methoxyphenyl)-5H-pyrazolo[1,5-d][1,2,4]triazine-4,7-dione
CID 101011150
2-(3-methoxyphenyl)-5-methyl-1H-pyrazol-3-one
CID 54414073
ethane;2-(3-methoxyphenyl)-3-methyl-1H-pyrazol-5-one
CID 143937149
5-ethyl-2-(3-methoxyphenyl)-4-methyl-1H-pyrazol-3-one
CID 114798023
2,6-dimethyl-N-[4-(trifluoromethoxy)-2-pyridinyl]pyrimidin-4-amine
CID 163629227
N-[5-[(E)-2-(3-methoxyphenyl)ethenyl]-2-pyridinyl]-2-methyl-6-piperazin-1-ylpyrimidin-4-amine
CID 89362353
4-(3-methoxyphenyl)-3-methyl-1H-1,2,4-triazol-5-one
CID 3843100
2-[(2,6-dimethylpyrimidin-4-yl)amino]-N-[(3-methoxyphenyl)methyl]-N-(2-methylphenyl)-1,3-thiazole-5-carboxamide
CID 58765487

Frequently Asked Questions

What is the IUPAC name of 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one?
The IUPAC name of 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one (CID 164548836) is 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one.
What is the SMILES notation for 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one?
The canonical SMILES for 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one is COc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)nc(C)n4)cc32)c1.
What is the InChIKey of 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one?
The InChIKey is PVWANZPOFPYQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-11-7-18(22-12(2)21-11)23-17-9-16-15(10-20-17)19(26)24-25(16)13-5-4-6-14(8-13)27-3/h4-10H,1-3H3,(H,24,26)(H,20,21,22,23).
What are the key properties of 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one?
6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one has a molecular weight of 362.39 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,6-dimethylpyrimidin-4-yl)amino]-1-(3-methoxyphenyl)-2H-pyrazolo[4,3-c]pyridin-3-one is sourced from PubChem (CID 164548836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).