3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide

C20H14IN3O — CID 167944597

IUPAC3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(Nc1cccc(-c2ccccc2)c1)c1ccc2ncc(I)n2c1
InChIInChI=1S/C20H14IN3O/c21-18-12-22-19-10-9-16(13-24(18)19)20(25)23-17-8-4-7-15(11-17)14-5-2-1-3-6-14/h1-13H,(H,23,25)
InChIKeySRQXJMYDPDJNHS-UHFFFAOYSA-N
MW439.26 g/mol
LogP4.86
Rot. Bonds3

About 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide

3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 167944597) has the molecular formula C20H14IN3O and a molecular weight of 439.26 g/mol. Its IUPAC name is 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID167944597
Molecular FormulaC20H14IN3O
Molecular Weight439.26 g/mol
Exact Mass439.02
IUPAC Name3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(Nc1cccc(-c2ccccc2)c1)c1ccc2ncc(I)n2c1
InChIInChI=1S/C20H14IN3O/c21-18-12-22-19-10-9-16(13-24(18)19)20(25)23-17-8-4-7-15(11-17)14-5-2-1-3-6-14/h1-13H,(H,23,25)
InChIKeySRQXJMYDPDJNHS-UHFFFAOYSA-N
XLogP4.86
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.26
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(3-methylimidazo[1,2-a]pyridin-6-yl)-3-pyridin-4-ylbenzamide
CID 167875225
N-[3-(4,6-dimethoxypyrimidin-2-yl)phenyl]-4-phenylbenzamide
CID 5018775
N-(3-pyridin-4-ylphenyl)pyridine-4-carboxamide
CID 166320523
3-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 47090674
(3-phenylphenyl)carbamic acid
CID 611602
3-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 53157931
3-phenyl-N-pyridin-3-ylbenzamide
CID 110723041
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
3-methoxy-N-(3-phenylphenyl)benzamide
CID 798645
N-(3-fluorophenyl)-2-phenylpyrimidine-5-carboxamide
CID 47779233
N-(3-methylphenyl)-2-phenylpyrimidine-5-carboxamide
CID 3634035
N-[3-(4-nitrophenyl)phenyl]benzamide
CID 170346171

Frequently Asked Questions

What is the IUPAC name of 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 167944597) is 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide is O=C(Nc1cccc(-c2ccccc2)c1)c1ccc2ncc(I)n2c1.
What is the InChIKey of 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is SRQXJMYDPDJNHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14IN3O/c21-18-12-22-19-10-9-16(13-24(18)19)20(25)23-17-8-4-7-15(11-17)14-5-2-1-3-6-14/h1-13H,(H,23,25).
What are the key properties of 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 439.26 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-N-(3-phenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 167944597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).