(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide

C23H18FN3O2 — CID 56582329

IUPAC(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide
SMILESO=C(/C=C/c1ccccc1F)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C23H18FN3O2/c24-21-9-2-1-6-17(21)11-12-23(28)26-18-7-5-8-20(14-18)29-16-19-15-27-13-4-3-10-22(27)25-19/h1-15H,16H2,(H,26,28)/b12-11+
InChIKeyAZQARAMNNZHXRU-VAWYXSNFSA-N
MW387.41 g/mol
LogP4.70
Rot. Bonds6

About (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide

(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide (PubChem CID 56582329) has the molecular formula C23H18FN3O2 and a molecular weight of 387.41 g/mol. Its IUPAC name is (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide
PubChem CID56582329
Molecular FormulaC23H18FN3O2
Molecular Weight387.41 g/mol
Exact Mass387.14
IUPAC Name(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide
SMILESO=C(/C=C/c1ccccc1F)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C23H18FN3O2/c24-21-9-2-1-6-17(21)11-12-23(28)26-18-7-5-8-20(14-18)29-16-19-15-27-13-4-3-10-22(27)25-19/h1-15H,16H2,(H,26,28)/b12-11+
InChIKeyAZQARAMNNZHXRU-VAWYXSNFSA-N
XLogP4.70
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.41
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-3-phenylprop-2-enamide
CID 56530976
(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide
CID 56530759
3,4-difluoro-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530610
3-(2-fluorophenyl)sulfanyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]propanamide
CID 56530513
N-[3-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-3-oxopropyl]benzamide
CID 56582393
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]naphthalene-1-carboxamide
CID 56537813
4-ethyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530964
4-chloro-N-[3-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-3-oxopropyl]benzamide
CID 56582434
4-[ethyl(methyl)amino]-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530641
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-4-methylsulfonylbenzamide
CID 56530937
N-[4-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 56537785

Frequently Asked Questions

What is the IUPAC name of (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide?
The IUPAC name of (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide (CID 56582329) is (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide.
What is the SMILES notation for (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide?
The canonical SMILES for (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide is O=C(/C=C/c1ccccc1F)Nc1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide?
The InChIKey is AZQARAMNNZHXRU-VAWYXSNFSA-N. The full InChI is InChI=1S/C23H18FN3O2/c24-21-9-2-1-6-17(21)11-12-23(28)26-18-7-5-8-20(14-18)29-16-19-15-27-13-4-3-10-22(27)25-19/h1-15H,16H2,(H,26,28)/b12-11+.
What are the key properties of (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide?
(E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide has a molecular weight of 387.41 g/mol, XLogP of 4.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(2-fluorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]prop-2-enamide is sourced from PubChem (CID 56582329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).