(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide

C22H16ClN3O — CID 122283426

IUPAC(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(Cl)cc1)Nc1cccc(-c2cn3ccccc3n2)c1
InChIInChI=1S/C22H16ClN3O/c23-18-10-7-16(8-11-18)9-12-22(27)24-19-5-3-4-17(14-19)20-15-26-13-2-1-6-21(26)25-20/h1-15H,(H,24,27)/b12-9+
InChIKeyCHYLCSXXASBZQQ-FMIVXFBMSA-N
MW373.84 g/mol
LogP5.31
Rot. Bonds4

About (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide

(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide (PubChem CID 122283426) has the molecular formula C22H16ClN3O and a molecular weight of 373.84 g/mol. Its IUPAC name is (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide
PubChem CID122283426
Molecular FormulaC22H16ClN3O
Molecular Weight373.84 g/mol
Exact Mass373.10
IUPAC Name(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(Cl)cc1)Nc1cccc(-c2cn3ccccc3n2)c1
InChIInChI=1S/C22H16ClN3O/c23-18-10-7-16(8-11-18)9-12-22(27)24-19-5-3-4-17(14-19)20-15-26-13-2-1-6-21(26)25-20/h1-15H,(H,24,27)/b12-9+
InChIKeyCHYLCSXXASBZQQ-FMIVXFBMSA-N
XLogP5.31
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.84
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)prop-2-enamide
CID 122285177
(E)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-phenylprop-2-enamide
CID 121055726
3,4-difluoro-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 122283315
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
CID 877528
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide
CID 845423
(E)-3-(4-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)prop-2-enamide
CID 98846407
3-(4-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)prop-2-enamide
CID 55825812
1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 121090060
(E)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-3-phenylprop-2-enamide
CID 56530976
3-(4-chlorophenyl)-N-(3-methylphenyl)prop-2-enamide
CID 692427
(E)-3-(4-chlorophenyl)-N-(3-methylphenyl)prop-2-enamide
CID 692428
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-2-pyrimidin-2-yloxyacetamide
CID 121086799

Frequently Asked Questions

What is the IUPAC name of (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide?
The IUPAC name of (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide (CID 122283426) is (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide?
The canonical SMILES for (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide is O=C(/C=C/c1ccc(Cl)cc1)Nc1cccc(-c2cn3ccccc3n2)c1.
What is the InChIKey of (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide?
The InChIKey is CHYLCSXXASBZQQ-FMIVXFBMSA-N. The full InChI is InChI=1S/C22H16ClN3O/c23-18-10-7-16(8-11-18)9-12-22(27)24-19-5-3-4-17(14-19)20-15-26-13-2-1-6-21(26)25-20/h1-15H,(H,24,27)/b12-9+.
What are the key properties of (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide?
(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide has a molecular weight of 373.84 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide is sourced from PubChem (CID 122283426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).