N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

C20H31N5O2 — CID 17488314

IUPACN-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C
InChIInChI=1S/C20H31N5O2/c1-8-24(11-18(26)22-13(4)5)20(27)15-9-17(12(2)3)23-19-16(15)10-21-25(19)14(6)7/h9-10,12-14H,8,11H2,1-7H3,(H,22,26)
InChIKeyQJHIWFHJIFVWPF-UHFFFAOYSA-N
MW373.50 g/mol
LogP3.12
Rot. Bonds7

About N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 17488314) has the molecular formula C20H31N5O2 and a molecular weight of 373.50 g/mol. Its IUPAC name is N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID17488314
Molecular FormulaC20H31N5O2
Molecular Weight373.50 g/mol
Exact Mass373.25
IUPAC NameN-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C
InChIInChI=1S/C20H31N5O2/c1-8-24(11-18(26)22-13(4)5)20(27)15-9-17(12(2)3)23-19-16(15)10-21-25(19)14(6)7/h9-10,12-14H,8,11H2,1-7H3,(H,22,26)
InChIKeyQJHIWFHJIFVWPF-UHFFFAOYSA-N
XLogP3.12
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 17488314) is N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is CCN(CC(=O)NC(C)C)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C.
What is the InChIKey of N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is QJHIWFHJIFVWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O2/c1-8-24(11-18(26)22-13(4)5)20(27)15-9-17(12(2)3)23-19-16(15)10-21-25(19)14(6)7/h9-10,12-14H,8,11H2,1-7H3,(H,22,26).
What are the key properties of N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 373.50 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 17488314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).