N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide

C17H13ClN4O2 — CID 177229827

IUPACN-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide
SMILESC=CC(=O)Nc1ccc2ncc(C(=O)Nc3ccccc3Cl)n2c1
InChIInChI=1S/C17H13ClN4O2/c1-2-16(23)20-11-7-8-15-19-9-14(22(15)10-11)17(24)21-13-6-4-3-5-12(13)18/h2-10H,1H2,(H,20,23)(H,21,24)
InChIKeyHDLFLBFMKSLTEO-UHFFFAOYSA-N
MW340.77 g/mol
LogP3.36
Rot. Bonds4

About N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide

N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 177229827) has the molecular formula C17H13ClN4O2 and a molecular weight of 340.77 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID177229827
Molecular FormulaC17H13ClN4O2
Molecular Weight340.77 g/mol
Exact Mass340.07
IUPAC NameN-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide
SMILESC=CC(=O)Nc1ccc2ncc(C(=O)Nc3ccccc3Cl)n2c1
InChIInChI=1S/C17H13ClN4O2/c1-2-16(23)20-11-7-8-15-19-9-14(22(15)10-11)17(24)21-13-6-4-3-5-12(13)18/h2-10H,1H2,(H,20,23)(H,21,24)
InChIKeyHDLFLBFMKSLTEO-UHFFFAOYSA-N
XLogP3.36
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.77
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-(2-chlorophenyl)-6-phenylimidazo[1,2-a]pyridine-3-carboxamide
CID 46882707
N-(2-chlorophenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 46882706
7-[[(E)-but-2-enoyl]amino]-N-(2-chlorophenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 177229812
N-(2-chlorophenyl)-7-(2-methylprop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide
CID 177229815
N-(2-chlorophenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 4572245
N-(2-chlorophenyl)-7-(hydroxymethyl)-6-piperidin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 164924677
N-[4-chloro-3-[(2-chlorophenyl)sulfamoyl]phenyl]prop-2-enamide
CID 167764718
N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42271470
N-[4-[(2-chlorophenyl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 56688132
1-(6-chloroimidazo[1,2-a]pyridin-3-yl)-2-phenylethane-1,2-dione
CID 132969705
N-(2-chlorophenyl)-2-methylimidazo[1,2-b]pyridazine-6-carboxamide
CID 155799171
N-(4-phenyldiazenylphenyl)prop-2-enamide
CID 21498516

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide (CID 177229827) is N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide is C=CC(=O)Nc1ccc2ncc(C(=O)Nc3ccccc3Cl)n2c1.
What is the InChIKey of N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is HDLFLBFMKSLTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN4O2/c1-2-16(23)20-11-7-8-15-19-9-14(22(15)10-11)17(24)21-13-6-4-3-5-12(13)18/h2-10H,1H2,(H,20,23)(H,21,24).
What are the key properties of N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide?
N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 340.77 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-6-(prop-2-enoylamino)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 177229827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).