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

C16H19N7O3 — CID 11428274

IUPAC2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CCOCC3)c21
InChIInChI=1S/C16H19N7O3/c1-2-23-13-10(16(24)19-9-3-5-25-6-4-9)7-18-8-11(13)20-15(23)12-14(17)22-26-21-12/h7-9H,2-6H2,1H3,(H2,17,22)(H,19,24)
InChIKeyZEAZYQABPWARHZ-UHFFFAOYSA-N
MW357.37 g/mol
LogP0.99
Rot. Bonds4

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

2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide (PubChem CID 11428274) has the molecular formula C16H19N7O3 and a molecular weight of 357.37 g/mol. Its IUPAC name is 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
PubChem CID11428274
Molecular FormulaC16H19N7O3
Molecular Weight357.37 g/mol
Exact Mass357.15
IUPAC Name2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CCOCC3)c21
InChIInChI=1S/C16H19N7O3/c1-2-23-13-10(16(24)19-9-3-5-25-6-4-9)7-18-8-11(13)20-15(23)12-14(17)22-26-21-12/h7-9H,2-6H2,1H3,(H2,17,22)(H,19,24)
InChIKeyZEAZYQABPWARHZ-UHFFFAOYSA-N
XLogP0.99
TPSA133.98 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 50.99
H-Bond Donors ≤ 52
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-(oxan-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-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide (CID 11428274) is 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-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-(oxan-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-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide is CCn1c(-c2nonc2N)nc2cncc(C(=O)NC3CCOCC3)c21.
What is the InChIKey of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
The InChIKey is ZEAZYQABPWARHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N7O3/c1-2-23-13-10(16(24)19-9-3-5-25-6-4-9)7-18-8-11(13)20-15(23)12-14(17)22-26-21-12/h7-9H,2-6H2,1H3,(H2,17,22)(H,19,24).
What are the key properties of 2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide?
2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-N-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide has a molecular weight of 357.37 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 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-(oxan-4-yl)imidazo[4,5-c]pyridine-7-carboxamide is sourced from PubChem (CID 11428274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).