3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide

C15H15N5O2 — CID 146000057

IUPAC3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide
SMILESCC1=C(C(=O)Nc2ccccc2C)C2=NN=C(N)C2C(=O)N1
InChIInChI=1S/C15H15N5O2/c1-7-5-3-4-6-9(7)18-14(21)10-8(2)17-15(22)11-12(10)19-20-13(11)16/h3-6,11H,1-2H3,(H2,16,20)(H,17,22)(H,18,21)
InChIKeyAIKBZGNBZGIVSF-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.68
Rot. Bonds2

About 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide

3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide (PubChem CID 146000057) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide
PubChem CID146000057
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide
SMILESCC1=C(C(=O)Nc2ccccc2C)C2=NN=C(N)C2C(=O)N1
InChIInChI=1S/C15H15N5O2/c1-7-5-3-4-6-9(7)18-14(21)10-8(2)17-15(22)11-12(10)19-20-13(11)16/h3-6,11H,1-2H3,(H2,16,20)(H,17,22)(H,18,21)
InChIKeyAIKBZGNBZGIVSF-UHFFFAOYSA-N
XLogP0.68
TPSA108.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-2,2-dimethyl-N-(2-methylphenyl)-6-oxo-1,3-dioxine-5-carboxamide
CID 10912806
2-(azetidin-3-yl)-N-(2-methylphenyl)acetamide
CID 64615932
4,6-dimethyl-N-(2-methylphenyl)pyridine-2-carboxamide
CID 19224338
(4R)-6-methyl-N-(2-methylphenyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 695897
(2-methylphenyl)urea;phosphane
CID 175888509
2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)-N-(2-methylphenyl)acetamide
CID 171347082
N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 23633101
4-(2-hydroxyphenyl)-6-methyl-N-(2-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 2851771
N-(2-methylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261390
2-amino-6-methyl-N-(2-methylphenyl)pyridine-4-carboxamide
CID 113378981
7-(5-bromofuran-2-yl)-5-methyl-N-(2-methylphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 135805589
6-methyl-N-(2-methylphenyl)-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 4672551

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide?
The IUPAC name of 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide (CID 146000057) is 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide?
The canonical SMILES for 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide is CC1=C(C(=O)Nc2ccccc2C)C2=NN=C(N)C2C(=O)N1.
What is the InChIKey of 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide?
The InChIKey is AIKBZGNBZGIVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-7-5-3-4-6-9(7)18-14(21)10-8(2)17-15(22)11-12(10)19-20-13(11)16/h3-6,11H,1-2H3,(H2,16,20)(H,17,22)(H,18,21).
What are the key properties of 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide?
3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide has a molecular weight of 297.32 g/mol, XLogP of 0.68, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-methyl-N-(2-methylphenyl)-4-oxo-3a,5-dihydropyrazolo[4,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 146000057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).