2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid

C21H16N4O3 — CID 25105471

IUPAC2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1nc(-c2ccccc2)cc2c1ncn2-c1ccccc1
InChIInChI=1S/C21H16N4O3/c26-18(27)12-22-21(28)20-19-17(11-16(24-20)14-7-3-1-4-8-14)25(13-23-19)15-9-5-2-6-10-15/h1-11,13H,12H2,(H,22,28)(H,26,27)
InChIKeyWGYLKBODGCGXHY-UHFFFAOYSA-N
MW372.38 g/mol
LogP2.90
Rot. Bonds5

About 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid

2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid (PubChem CID 25105471) has the molecular formula C21H16N4O3 and a molecular weight of 372.38 g/mol. Its IUPAC name is 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid
PubChem CID25105471
Molecular FormulaC21H16N4O3
Molecular Weight372.38 g/mol
Exact Mass372.12
IUPAC Name2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1nc(-c2ccccc2)cc2c1ncn2-c1ccccc1
InChIInChI=1S/C21H16N4O3/c26-18(27)12-22-21(28)20-19-17(11-16(24-20)14-7-3-1-4-8-14)25(13-23-19)15-9-5-2-6-10-15/h1-11,13H,12H2,(H,22,28)(H,26,27)
InChIKeyWGYLKBODGCGXHY-UHFFFAOYSA-N
XLogP2.90
TPSA97.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid?
The IUPAC name of 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid (CID 25105471) is 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid is O=C(O)CNC(=O)c1nc(-c2ccccc2)cc2c1ncn2-c1ccccc1.
What is the InChIKey of 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid?
The InChIKey is WGYLKBODGCGXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O3/c26-18(27)12-22-21(28)20-19-17(11-16(24-20)14-7-3-1-4-8-14)25(13-23-19)15-9-5-2-6-10-15/h1-11,13H,12H2,(H,22,28)(H,26,27).
What are the key properties of 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid?
2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid has a molecular weight of 372.38 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,6-diphenylimidazo[4,5-c]pyridine-4-carbonyl)amino]acetic acid is sourced from PubChem (CID 25105471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).