(E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamide

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Basic information

CAS: 6195-03-5
Standard SMILES: Cc1ccnc(NC(=O)/C=C/c2ccc3c(c2)OCO3)c1
InChIKey: VOWFCWDUYDBXCA-HWKANZROSA-N
Molecular formula: C16H14N2O3
Average molar mass: 282.29 g/mol
Monoisotopic mass: 282.10044231

Names & identifiers

Preferred name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamide
IUPAC: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methyl-2-pyridinyl)prop-2-enamide

Names & synonyms

6195-03-5AC1LEYQ5DTXSID80351249SMSF0017016STK014004(2E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamide(E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamideAKOS000646893CB14284BIM-0011063.P001ST50324553AB00104048-01

Show more names

3-(1,3-benzodioxol-5-yl)-N-(4-methyl-2-pyridinyl)acrylamide(E)-3-(benzo[d][1,3]dioxol-5-yl)-N-(4-methylpyridin-2-yl)acrylamide(2E)-3-(2H-1,3-BENZODIOXOL-5-YL)-N-(4-METHYLPYRIDIN-2-YL)PROP-2-ENAMIDE(2E)-3-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-N-(4-methyl(2-pyridyl))prop-2-enamid e

Database identifiers

CAS: 6195-03-5
PubChem CID: 694728
DTXSID: DTXSID80351249

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 60.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 399

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Compound notes

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