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

C23H23N5O2 — CID 166183089

IUPAC6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(C3CC3)cc(C(=O)NCCc3coc(-c4ccccc4)n3)c12
InChIInChI=1S/C23H23N5O2/c1-14-20-18(12-19(15-8-9-15)26-21(20)28(2)27-14)22(29)24-11-10-17-13-30-23(25-17)16-6-4-3-5-7-16/h3-7,12-13,15H,8-11H2,1-2H3,(H,24,29)
InChIKeyKKCPZKJAERPDAB-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.78
Rot. Bonds6

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

6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 166183089) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID166183089
Molecular FormulaC23H23N5O2
Molecular Weight401.47 g/mol
Exact Mass401.19
IUPAC Name6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(C3CC3)cc(C(=O)NCCc3coc(-c4ccccc4)n3)c12
InChIInChI=1S/C23H23N5O2/c1-14-20-18(12-19(15-8-9-15)26-21(20)28(2)27-14)22(29)24-11-10-17-13-30-23(25-17)16-6-4-3-5-7-16/h3-7,12-13,15H,8-11H2,1-2H3,(H,24,29)
InChIKeyKKCPZKJAERPDAB-UHFFFAOYSA-N
XLogP3.78
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,3-dimethyl-6-phenyl-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 154806949
6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 31700057
N-butyl-6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46514383
6-cyclopropyl-N'-(2-fluorobenzoyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbohydrazide
CID 31761752
6-cyclopropyl-1,3-dimethyl-N-prop-2-enylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16609834
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
N-[(2S)-2-anilino-3-methylbutyl]-6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 95303336
6-cyclopropyl-N-(3,3-dimethyl-2-oxobutyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 95753508
N-(2-hydroxyethyl)-1,3-dimethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 56763090
6-cyclopropyl-1,3-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 19496010
6-cyclopropyl-1,3-dimethyl-N-(oxolan-2-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 45148427

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide (CID 166183089) is 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide is Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCCc3coc(-c4ccccc4)n3)c12.
What is the InChIKey of 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is KKCPZKJAERPDAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c1-14-20-18(12-19(15-8-9-15)26-21(20)28(2)27-14)22(29)24-11-10-17-13-30-23(25-17)16-6-4-3-5-7-16/h3-7,12-13,15H,8-11H2,1-2H3,(H,24,29).
What are the key properties of 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 401.47 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1,3-dimethyl-N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 166183089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).