4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

C16H17N5O2 — CID 11301381

IUPAC4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCOc1ccccc1Nc1c(C(N)=O)cnc2c1c(C)nn2C
InChIInChI=1S/C16H17N5O2/c1-9-13-14(19-11-6-4-5-7-12(11)23-3)10(15(17)22)8-18-16(13)21(2)20-9/h4-8H,1-3H3,(H2,17,22)(H,18,19)
InChIKeyDZODJYSTBGCNLF-UHFFFAOYSA-N
MW311.35 g/mol
LogP2.13
Rot. Bonds4

About 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 11301381) has the molecular formula C16H17N5O2 and a molecular weight of 311.35 g/mol. Its IUPAC name is 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID11301381
Molecular FormulaC16H17N5O2
Molecular Weight311.35 g/mol
Exact Mass311.14
IUPAC Name4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCOc1ccccc1Nc1c(C(N)=O)cnc2c1c(C)nn2C
InChIInChI=1S/C16H17N5O2/c1-9-13-14(19-11-6-4-5-7-12(11)23-3)10(15(17)22)8-18-16(13)21(2)20-9/h4-8H,1-3H3,(H2,17,22)(H,18,19)
InChIKeyDZODJYSTBGCNLF-UHFFFAOYSA-N
XLogP2.13
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(azetidine-1-carbonyl)-N-[2-[3-(fluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-methylpyrazole-5-carboxamide
CID 57378844
HCAR2 agonist 1
CID 25101223
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid [2-(3-methoxy-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-amide
CID 57378494
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid [2-(2-methoxy-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-amide
CID 57378960
1-[3-(4-Amino-7-cyclopentylpyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-methoxy-5-methylphenyl)urea
CID 67218825
US10774086, Example 24
CID 139465947
Ethyl 4-(4-hydroxyanilino)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 11406597
7-(difluoromethyl)-N-(2-methoxybenzyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 975142
rac-3-(4-isopropylphenyl)-7-methyl-N-(1-phenoxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 44579762
4-(azetidine-1-carbonyl)-N-[2-[2-(fluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-methylpyrazole-5-carboxamide
CID 165414866
5-[2-(2-methoxy-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-7-ylcarbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid ethyl ester
CID 67775649
N-[2-(dimethylamino)ethyl]-4-[(1E)-{2-[1-(3-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]hydrazin-1-ylidene}methyl]benzamide
CID 91299904

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide (CID 11301381) is 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide is COc1ccccc1Nc1c(C(N)=O)cnc2c1c(C)nn2C.
What is the InChIKey of 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is DZODJYSTBGCNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2/c1-9-13-14(19-11-6-4-5-7-12(11)23-3)10(15(17)22)8-18-16(13)21(2)20-9/h4-8H,1-3H3,(H2,17,22)(H,18,19).
What are the key properties of 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 311.35 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyanilino)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 11301381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).