6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide

C21H19N5O3 — CID 16622390

IUPAC6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)cc1
InChIInChI=1S/C21H19N5O3/c1-12-18-15(21(28)23-14-8-6-13(7-9-14)20(27)22-2)11-16(17-5-4-10-29-17)24-19(18)26(3)25-12/h4-11H,1-3H3,(H,22,27)(H,23,28)
InChIKeyDEJATGWMDNLDQV-UHFFFAOYSA-N
MW389.42 g/mol
LogP3.15
Rot. Bonds4

About 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide

6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 16622390) has the molecular formula C21H19N5O3 and a molecular weight of 389.42 g/mol. Its IUPAC name is 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID16622390
Molecular FormulaC21H19N5O3
Molecular Weight389.42 g/mol
Exact Mass389.15
IUPAC Name6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)cc1
InChIInChI=1S/C21H19N5O3/c1-12-18-15(21(28)23-14-8-6-13(7-9-14)20(27)22-2)11-16(17-5-4-10-29-17)24-19(18)26(3)25-12/h4-11H,1-3H3,(H,22,27)(H,23,28)
InChIKeyDEJATGWMDNLDQV-UHFFFAOYSA-N
XLogP3.15
TPSA102.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.42
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(furan-2-yl)-1,3-dimethyl-N-(4-methylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 16609317
6-(furan-2-yl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 24627205
S-[4-[[6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56576852
N-(3,4-diethoxyphenyl)-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16621919
N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16622496
6-(furan-2-yl)-1,3-dimethyl-N-naphthalen-1-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16620803
N-[2,6-di(propan-2-yl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16620877
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16621304
N-cyclopropyl-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 35185320
N'-(4-ethoxybenzoyl)-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbohydrazide
CID 35186541
N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16620962
N-[4-(dimethylamino)-2-methylphenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55780235

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide (CID 16622390) is 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide is CNC(=O)c1ccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)cc1.
What is the InChIKey of 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is DEJATGWMDNLDQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O3/c1-12-18-15(21(28)23-14-8-6-13(7-9-14)20(27)22-2)11-16(17-5-4-10-29-17)24-19(18)26(3)25-12/h4-11H,1-3H3,(H,22,27)(H,23,28).
What are the key properties of 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 389.42 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 16622390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).