6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C24H28FN5O — CID 86965305

IUPAC6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1ccc(F)c(N2CCCC(NC(=O)c3cc(C4CC4)nc4c3c(C)nn4C)C2)c1
InChIInChI=1S/C24H28FN5O/c1-14-6-9-19(25)21(11-14)30-10-4-5-17(13-30)26-24(31)18-12-20(16-7-8-16)27-23-22(18)15(2)28-29(23)3/h6,9,11-12,16-17H,4-5,7-8,10,13H2,1-3H3,(H,26,31)
InChIKeyBVRDTYCIUCBHFS-UHFFFAOYSA-N
MW421.52 g/mol
LogP4.00
Rot. Bonds4

About 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 86965305) has the molecular formula C24H28FN5O and a molecular weight of 421.52 g/mol. Its IUPAC name is 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID86965305
Molecular FormulaC24H28FN5O
Molecular Weight421.52 g/mol
Exact Mass421.23
IUPAC Name6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1ccc(F)c(N2CCCC(NC(=O)c3cc(C4CC4)nc4c3c(C)nn4C)C2)c1
InChIInChI=1S/C24H28FN5O/c1-14-6-9-19(25)21(11-14)30-10-4-5-17(13-30)26-24(31)18-12-20(16-7-8-16)27-23-22(18)15(2)28-29(23)3/h6,9,11-12,16-17H,4-5,7-8,10,13H2,1-3H3,(H,26,31)
InChIKeyBVRDTYCIUCBHFS-UHFFFAOYSA-N
XLogP4.00
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.52
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide with MolForge

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Related Compounds

N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-2-(1,4,6-trimethylpyrazolo[5,4-b]pyridin-3-yl)oxyacetamide
CID 86965207
2,5-difluoro-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]benzamide
CID 86965224
6-cyclopropyl-N'-(2-fluorobenzoyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbohydrazide
CID 31761752
6-cyclopropyl-N-[1-(2,5-dimethylphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46564121
(6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridin-4-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 134028095
6-cyclopropyl-1,3-dimethyl-N-methylsulfonylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 146154521
6-cyclopropyl-N-(dicyclopropylmethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 36574852
1-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-3-(2-hydroxyethyl)urea
CID 111424850
N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-2-methyl-3-nitrobenzamide
CID 86965404
6-cyclopropyl-1,3-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 45148429
6-cyclopropyl-1,3-dimethyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 52555857
(6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridin-4-yl)-pyrrolidin-1-ylmethanone
CID 39891388

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 86965305) is 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1ccc(F)c(N2CCCC(NC(=O)c3cc(C4CC4)nc4c3c(C)nn4C)C2)c1.
What is the InChIKey of 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is BVRDTYCIUCBHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28FN5O/c1-14-6-9-19(25)21(11-14)30-10-4-5-17(13-30)26-24(31)18-12-20(16-7-8-16)27-23-22(18)15(2)28-29(23)3/h6,9,11-12,16-17H,4-5,7-8,10,13H2,1-3H3,(H,26,31).
What are the key properties of 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 421.52 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 86965305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).