6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C21H24N4O2 — CID 31700057

IUPAC6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C
InChIInChI=1S/C21H24N4O2/c1-13-19-16(12-17(14-8-9-14)23-20(19)25(2)24-13)21(26)22-11-10-15-6-4-5-7-18(15)27-3/h4-7,12,14H,8-11H2,1-3H3,(H,22,26)
InChIKeyUFNZYFMVHASPHH-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.14
Rot. Bonds6

About 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 31700057) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID31700057
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C
InChIInChI=1S/C21H24N4O2/c1-13-19-16(12-17(14-8-9-14)23-20(19)25(2)24-13)21(26)22-11-10-15-6-4-5-7-18(15)27-3/h4-7,12,14H,8-11H2,1-3H3,(H,22,26)
InChIKeyUFNZYFMVHASPHH-UHFFFAOYSA-N
XLogP3.14
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 31700057) is 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is COc1ccccc1CCNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C.
What is the InChIKey of 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is UFNZYFMVHASPHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-13-19-16(12-17(14-8-9-14)23-20(19)25(2)24-13)21(26)22-11-10-15-6-4-5-7-18(15)27-3/h4-7,12,14H,8-11H2,1-3H3,(H,22,26).
What are the key properties of 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 31700057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).