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N-{4-[(2E)-3-(dimethylamino)prop-2-enoyl]phenyl}acetamide

N-{4-[(2E)-3-(dimethylamino)prop-2-enoyl]phenyl}acetamide

CAS: 96605-63-9

Formula: C13H16N2O2

SMILES: CN(C)C=CC(=O)C1=CC=C(NC(C)=O)C=C1

IUPAC: N-{4-[(2E)-3-(dimethylamino)prop-2-enoyl]phenyl}acetamide

InChI: InChI=1S/C13H16N2O2/c1-10(16)14-12-6-4-11(5-7-12)13(17)8-9-15(2)3/h4-9H,1-3H3,(H,14,16)/b9-8+

Composition: C (67.22%), H (6.94%), N (12.06%), O (13.78%)

Molar Mass: 232.283

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 232.121177763
Formal Charge 0
FSP3 0.23
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FBZDFAKFAMKMMN-CMDGGOBGSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.68
Topological Polar Surface Area 49.41
Polarizability 25.36
Ring Count 1
Rotatable Bond Count 4

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