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

C26H33N5O — CID 55725185

IUPAC6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(C3CC3)cc(C(=O)NCc3ccccc3CN3CCCC(C)C3)c12
InChIInChI=1S/C26H33N5O/c1-17-7-6-12-31(15-17)16-21-9-5-4-8-20(21)14-27-26(32)22-13-23(19-10-11-19)28-25-24(22)18(2)29-30(25)3/h4-5,8-9,13,17,19H,6-7,10-12,14-16H2,1-3H3,(H,27,32)
InChIKeyQBNRMRJBZBHAQG-UHFFFAOYSA-N
MW431.58 g/mol
LogP4.32
Rot. Bonds6

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

6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55725185) has the molecular formula C26H33N5O and a molecular weight of 431.58 g/mol. Its IUPAC name is 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID55725185
Molecular FormulaC26H33N5O
Molecular Weight431.58 g/mol
Exact Mass431.27
IUPAC Name6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(C3CC3)cc(C(=O)NCc3ccccc3CN3CCCC(C)C3)c12
InChIInChI=1S/C26H33N5O/c1-17-7-6-12-31(15-17)16-21-9-5-4-8-20(21)14-27-26(32)22-13-23(19-10-11-19)28-25-24(22)18(2)29-30(25)3/h4-5,8-9,13,17,19H,6-7,10-12,14-16H2,1-3H3,(H,27,32)
InChIKeyQBNRMRJBZBHAQG-UHFFFAOYSA-N
XLogP4.32
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.58
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
CID 55714039
6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 31700057
6-cyclopropyl-1,3-dimethyl-N-[[4-(phenoxymethyl)phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55689006
6-cyclopropyl-N-(2-hydroxypropyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 110886666
6-cyclopropyl-N-[[3-(ethylcarbamoyl)phenyl]methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55724425
N-butyl-6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46514383
6-cyclopropyl-1,3-dimethyl-N-prop-2-enylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16609834
N,1-dibenzyl-6-cyclopropyl-3-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 44821533
4-bromo-5-methyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-1H-pyrazole-3-carboxamide
CID 55885078
2,5-dichloro-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]thiophene-3-carboxamide
CID 55718125
6-cyclopropyl-1,3-dimethyl-N-[(3-sulfamoylphenyl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 38321023
6-cyclopropyl-N-(3,3-dimethyl-2-oxobutyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 95753508

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide (CID 55725185) is 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide is Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCc3ccccc3CN3CCCC(C)C3)c12.
What is the InChIKey of 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is QBNRMRJBZBHAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O/c1-17-7-6-12-31(15-17)16-21-9-5-4-8-20(21)14-27-26(32)22-13-23(19-10-11-19)28-25-24(22)18(2)29-30(25)3/h4-5,8-9,13,17,19H,6-7,10-12,14-16H2,1-3H3,(H,27,32).
What are the key properties of 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 431.58 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55725185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).