3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide

C20H23N5O — CID 135253218

IUPAC3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc3c(c2)c(C)nn3C2CCNCC2)cc1
InChIInChI=1S/C20H23N5O/c1-13-3-5-16(6-4-13)23-20(26)15-11-18-14(2)24-25(19(18)22-12-15)17-7-9-21-10-8-17/h3-6,11-12,17,21H,7-10H2,1-2H3,(H,23,26)
InChIKeyPHRYHHDNXSCJKJ-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.22
Rot. Bonds3

About 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide

3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 135253218) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide
PubChem CID135253218
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc3c(c2)c(C)nn3C2CCNCC2)cc1
InChIInChI=1S/C20H23N5O/c1-13-3-5-16(6-4-13)23-20(26)15-11-18-14(2)24-25(19(18)22-12-15)17-7-9-21-10-8-17/h3-6,11-12,17,21H,7-10H2,1-2H3,(H,23,26)
InChIKeyPHRYHHDNXSCJKJ-UHFFFAOYSA-N
XLogP3.22
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(dimethylamino)phenyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 78839537
N-(4-methoxyphenyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 31316920
N-[4-(diethylamino)phenyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 30898812
N-[4-(2-hydroxyethyl)phenyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 110902184
1,3-dimethyl-N-(4-pyrimidin-2-yloxyphenyl)pyrazolo[5,4-b]pyridine-5-carboxamide
CID 87010918
1,3-dimethyl-N-[4-(morpholin-4-ylmethyl)phenyl]pyrazolo[5,4-b]pyridine-5-carboxamide
CID 86917104
3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 141435483
1-(1H-benzimidazol-2-yl)-N-[4-(4-cyclopropylpiperazin-1-yl)phenyl]-3-methylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 166190915
N-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 31327880
6-fluoro-N-(4-methylphenyl)quinoline-3-carboxamide
CID 110489843
N-(3-chloro-4-cyanophenyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 78839832
N-[4-(4-amino-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 71015294

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide (CID 135253218) is 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide is Cc1ccc(NC(=O)c2cnc3c(c2)c(C)nn3C2CCNCC2)cc1.
What is the InChIKey of 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is PHRYHHDNXSCJKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-13-3-5-16(6-4-13)23-20(26)15-11-18-14(2)24-25(19(18)22-12-15)17-7-9-21-10-8-17/h3-6,11-12,17,21H,7-10H2,1-2H3,(H,23,26).
What are the key properties of 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide?
3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 349.44 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 135253218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).