2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine

C19H14N4O2 — CID 123510105

IUPAC2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
SMILESO=[N+]([O-])c1ccc(-c2nc3ccccn3c2Nc2ccccc2)cc1
InChIInChI=1S/C19H14N4O2/c24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18/h1-13,20H
InChIKeyCXURXIPLRSOWMQ-UHFFFAOYSA-N
MW330.35 g/mol
LogP4.65
Rot. Bonds4

About 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine

2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine (PubChem CID 123510105) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
PubChem CID123510105
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Name2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
SMILESO=[N+]([O-])c1ccc(-c2nc3ccccn3c2Nc2ccccc2)cc1
InChIInChI=1S/C19H14N4O2/c24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18/h1-13,20H
InChIKeyCXURXIPLRSOWMQ-UHFFFAOYSA-N
XLogP4.65
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 4-(3-anilinoimidazo[1,2-a]pyridin-2-yl)benzoate
CID 164601102
N,2-bis(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 58564445
N-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 167713581
2-(furan-2-yl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 6621186
9-(4-nitrophenyl)-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene
CID 101436702
2-N-(4-nitrophenyl)-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine
CID 71593523
N,N-dimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)amino]benzamide
CID 102476670
2-(3-nitropyrazol-1-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 87023971
2-(3-chloro-2-fluorophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 91259410
6-chloro-2-N-(4-nitrophenyl)-4-N-phenyl-1,3,5-triazine-2,4-diamine
CID 4187713
1-(4-methylphenyl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 4825752
3-fluoro-2-(3-nitrophenyl)imidazo[1,2-a]pyridine
CID 122403866

Frequently Asked Questions

What is the IUPAC name of 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine (CID 123510105) is 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine is O=[N+]([O-])c1ccc(-c2nc3ccccn3c2Nc2ccccc2)cc1.
What is the InChIKey of 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is CXURXIPLRSOWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18/h1-13,20H.
What are the key properties of 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 330.35 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 123510105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).