6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide

C21H20N6O — CID 44822544

IUPAC6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCn1ncc2c(C(=O)NCc3cnn(-c4ccccc4)c3)cc(C3CC3)nc21
InChIInChI=1S/C21H20N6O/c1-26-20-18(12-23-26)17(9-19(25-20)15-7-8-15)21(28)22-10-14-11-24-27(13-14)16-5-3-2-4-6-16/h2-6,9,11-13,15H,7-8,10H2,1H3,(H,22,28)
InChIKeyUZDCGPVIZXRAPA-UHFFFAOYSA-N
MW372.43 g/mol
LogP2.96
Rot. Bonds5

About 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 44822544) has the molecular formula C21H20N6O and a molecular weight of 372.43 g/mol. Its IUPAC name is 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID44822544
Molecular FormulaC21H20N6O
Molecular Weight372.43 g/mol
Exact Mass372.17
IUPAC Name6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCn1ncc2c(C(=O)NCc3cnn(-c4ccccc4)c3)cc(C3CC3)nc21
InChIInChI=1S/C21H20N6O/c1-26-20-18(12-23-26)17(9-19(25-20)15-7-8-15)21(28)22-10-14-11-24-27(13-14)16-5-3-2-4-6-16/h2-6,9,11-13,15H,7-8,10H2,1H3,(H,22,28)
InChIKeyUZDCGPVIZXRAPA-UHFFFAOYSA-N
XLogP2.96
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-cyclopropyl-1-methyl-N-[(2-pyrazol-1-ylphenyl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 44822740
6-cyclopropyl-N-[2-(dimethylamino)ethyl]-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 166634178
6-cyclopropyl-1-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 44823340
2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide
CID 51083364
3,6-dicyclopropyl-N-[(1-ethylpyrazol-4-yl)methyl]-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 19588428
6-cyclopropyl-1-methyl-N-[(2S)-2-methyl-3-(3-methylpyrazol-1-yl)propyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 51854183
N-cycloheptyl-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 19617086
N-cyclohexyl-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 19617014
6-cyclopropyl-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 19617243
6-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-phenylethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 41131764
1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 167942015
2-N,6-N-bis[(1-phenylpyrazol-4-yl)methyl]pyridine-2,6-dicarboxamide
CID 39058604

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide (CID 44822544) is 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide is Cn1ncc2c(C(=O)NCc3cnn(-c4ccccc4)c3)cc(C3CC3)nc21.
What is the InChIKey of 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is UZDCGPVIZXRAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N6O/c1-26-20-18(12-23-26)17(9-19(25-20)15-7-8-15)21(28)22-10-14-11-24-27(13-14)16-5-3-2-4-6-16/h2-6,9,11-13,15H,7-8,10H2,1H3,(H,22,28).
What are the key properties of 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-methyl-N-[(1-phenylpyrazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 44822544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).