(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one

C18H14N4O2 — CID 10805494

IUPAC(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one
SMILESCOC1=N/C(=C\c2cnc3ccccn23)C(=O)N1c1ccccc1
InChIInChI=1S/C18H14N4O2/c1-24-18-20-15(17(23)22(18)13-7-3-2-4-8-13)11-14-12-19-16-9-5-6-10-21(14)16/h2-12H,1H3/b15-11-
InChIKeyFYEKMTDBFDQSRV-PTNGSMBKSA-N
MW318.34 g/mol
LogP2.72
Rot. Bonds2

About (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one

(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one (PubChem CID 10805494) has the molecular formula C18H14N4O2 and a molecular weight of 318.34 g/mol. Its IUPAC name is (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one.

Molecular Properties

Compound Name(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one
PubChem CID10805494
Molecular FormulaC18H14N4O2
Molecular Weight318.34 g/mol
Exact Mass318.11
IUPAC Name(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one
SMILESCOC1=N/C(=C\c2cnc3ccccn23)C(=O)N1c1ccccc1
InChIInChI=1S/C18H14N4O2/c1-24-18-20-15(17(23)22(18)13-7-3-2-4-8-13)11-14-12-19-16-9-5-6-10-21(14)16/h2-12H,1H3/b15-11-
InChIKeyFYEKMTDBFDQSRV-PTNGSMBKSA-N
XLogP2.72
TPSA59.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[(E)-but-1-enyl]imidazo[1,2-a]pyridine
CID 16741623
(3E)-3-(imidazo[1,2-a]pyridin-3-ylmethylidene)-5-(3,4,5-trimethoxyphenyl)furan-2-one
CID 132537764
3-[(E)-3-phenylprop-1-enyl]imidazo[1,2-a]pyridine
CID 16741715
(5E)-5-(cyclopenta-2,4-dien-1-ylmethylidene)-2-ethoxy-3-phenylimidazol-4-one
CID 177386068
3-[imidazo[1,2-a]pyridin-3-yl-(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 11382661
(5Z)-5-[(4-methoxyphenyl)methylidene]-3-phenyl-2-selenomorpholin-4-ylimidazol-4-one
CID 11224062
S-(4-imidazo[1,2-a]pyridin-3-ylbut-3-enyl) ethanethioate
CID 170480250
3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
CID 67241302
methyl 2-[(4Z)-4-[(4-methoxyphenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetate
CID 21230696
3-(4-methoxybenzoyl)pyrido[1,2-a]pyrimidin-4-one
CID 97032771
(5E)-3-ethyl-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-2-methoxyimidazol-4-one
CID 11000107
(5Z)-5-benzylidene-3-phenyl-2-propan-2-ylsulfanylimidazol-4-one
CID 11023709

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one?
The IUPAC name of (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one (CID 10805494) is (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one.
What is the SMILES notation for (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one?
The canonical SMILES for (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one is COC1=N/C(=C\c2cnc3ccccn23)C(=O)N1c1ccccc1.
What is the InChIKey of (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one?
The InChIKey is FYEKMTDBFDQSRV-PTNGSMBKSA-N. The full InChI is InChI=1S/C18H14N4O2/c1-24-18-20-15(17(23)22(18)13-7-3-2-4-8-13)11-14-12-19-16-9-5-6-10-21(14)16/h2-12H,1H3/b15-11-.
What are the key properties of (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one?
(5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one has a molecular weight of 318.34 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(imidazo[1,2-a]pyridin-3-ylmethylidene)-2-methoxy-3-phenylimidazol-4-one is sourced from PubChem (CID 10805494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).