N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide

C14H10N4O3 — CID 110188171

IUPACN-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide
SMILESO=C(Nc1ccc2nccn2c1)c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C14H10N4O3/c19-14(10-2-1-3-12(8-10)18(20)21)16-11-4-5-13-15-6-7-17(13)9-11/h1-9H,(H,16,19)
InChIKeyQGFWSACEUDMBRE-UHFFFAOYSA-N
MW282.26 g/mol
LogP2.49
Rot. Bonds3

About N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide

N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide (PubChem CID 110188171) has the molecular formula C14H10N4O3 and a molecular weight of 282.26 g/mol. Its IUPAC name is N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide.

Molecular Properties

Compound NameN-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide
PubChem CID110188171
Molecular FormulaC14H10N4O3
Molecular Weight282.26 g/mol
Exact Mass282.08
IUPAC NameN-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide
SMILESO=C(Nc1ccc2nccn2c1)c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C14H10N4O3/c19-14(10-2-1-3-12(8-10)18(20)21)16-11-4-5-13-15-6-7-17(13)9-11/h1-9H,(H,16,19)
InChIKeyQGFWSACEUDMBRE-UHFFFAOYSA-N
XLogP2.49
TPSA89.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 52.49
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

3-nitro-N-[3-[(3-nitrobenzoyl)amino]phenyl]benzamide;hydrate
CID 45052608
4-[(3-nitrobenzoyl)amino]benzenesulfonyl chloride
CID 13315406
4-[(3-nitrobenzoyl)amino]pyridine-2-carboxylic acid
CID 63651069
N-[4-(benzimidazol-1-yl)phenyl]-3-nitrobenzamide
CID 46642196
3-[(3-nitrobenzoyl)amino]benzamide
CID 25431511
N-(3,5-dimethylphenyl)-3-nitrobenzamide
CID 710720
N-(3,5-difluorophenyl)-3-nitrobenzamide
CID 2990730
3-nitro-N-[4-(1H-pyrazol-5-yl)phenyl]benzamide
CID 38779436
N-[4-(dimethylamino)phenyl]-3-nitrobenzamide
CID 870378
3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 709324
N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 52880425
3-nitro-N-[2-[(3-nitrobenzoyl)amino]phenyl]benzamide
CID 4118809

Frequently Asked Questions

What is the IUPAC name of N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide?
The IUPAC name of N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide (CID 110188171) is N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide.
What is the SMILES notation for N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide?
The canonical SMILES for N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide is O=C(Nc1ccc2nccn2c1)c1cccc([N+](=O)[O-])c1.
What is the InChIKey of N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide?
The InChIKey is QGFWSACEUDMBRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O3/c19-14(10-2-1-3-12(8-10)18(20)21)16-11-4-5-13-15-6-7-17(13)9-11/h1-9H,(H,16,19).
What are the key properties of N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide?
N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide has a molecular weight of 282.26 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-imidazo[1,2-a]pyridin-6-yl-3-nitrobenzamide is sourced from PubChem (CID 110188171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).