2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide

C20H28N8O2 — CID 69157916

IUPAC2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c21
InChIInChI=1S/C20H28N8O2/c1-6-28-15-12(18(29)23-11-7-19(2,3)27-20(4,5)8-11)9-22-10-13(15)24-17(28)14-16(21)26-30-25-14/h9-11,27H,6-8H2,1-5H3,(H2,21,26)(H,23,29)
InChIKeyNJXIFKJYDNRFHH-UHFFFAOYSA-N
MW412.50 g/mol
LogP2.12
Rot. Bonds4

About 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide

2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide (PubChem CID 69157916) has the molecular formula C20H28N8O2 and a molecular weight of 412.50 g/mol. Its IUPAC name is 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
PubChem CID69157916
Molecular FormulaC20H28N8O2
Molecular Weight412.50 g/mol
Exact Mass412.23
IUPAC Name2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c21
InChIInChI=1S/C20H28N8O2/c1-6-28-15-12(18(29)23-11-7-19(2,3)27-20(4,5)8-11)9-22-10-13(15)24-17(28)14-16(21)26-30-25-14/h9-11,27H,6-8H2,1-5H3,(H2,21,26)(H,23,29)
InChIKeyNJXIFKJYDNRFHH-UHFFFAOYSA-N
XLogP2.12
TPSA136.78 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.50
LogP ≤ 52.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
The IUPAC name of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide (CID 69157916) is 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide.
What is the SMILES notation for 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
The canonical SMILES for 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide is CCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c21.
What is the InChIKey of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
The InChIKey is NJXIFKJYDNRFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N8O2/c1-6-28-15-12(18(29)23-11-7-19(2,3)27-20(4,5)8-11)9-22-10-13(15)24-17(28)14-16(21)26-30-25-14/h9-11,27H,6-8H2,1-5H3,(H2,21,26)(H,23,29).
What are the key properties of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide has a molecular weight of 412.50 g/mol, XLogP of 2.12, 4 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)imidazo[4,5-c]pyridine-7-carboxamide is sourced from PubChem (CID 69157916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).