(E)-N-methyl-4-phenylbut-3-enamide

C11H13NO — CID 59663964

IUPAC(E)-N-methyl-4-phenylbut-3-enamide
SMILESCNC(=O)C/C=C/c1ccccc1
InChIInChI=1S/C11H13NO/c1-12-11(13)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3,(H,12,13)/b8-5+
InChIKeyWERDNYMSOFFSAL-VMPITWQZSA-N
MW175.23 g/mol
LogP1.84
Rot. Bonds3

About (E)-N-methyl-4-phenylbut-3-enamide

(E)-N-methyl-4-phenylbut-3-enamide (PubChem CID 59663964) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is (E)-N-methyl-4-phenylbut-3-enamide.

Molecular Properties

Compound Name(E)-N-methyl-4-phenylbut-3-enamide
PubChem CID59663964
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name(E)-N-methyl-4-phenylbut-3-enamide
SMILESCNC(=O)C/C=C/c1ccccc1
InChIInChI=1S/C11H13NO/c1-12-11(13)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3,(H,12,13)/b8-5+
InChIKeyWERDNYMSOFFSAL-VMPITWQZSA-N
XLogP1.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-N-methyl-4-phenylbut-3-enamide?
The IUPAC name of (E)-N-methyl-4-phenylbut-3-enamide (CID 59663964) is (E)-N-methyl-4-phenylbut-3-enamide.
What is the SMILES notation for (E)-N-methyl-4-phenylbut-3-enamide?
The canonical SMILES for (E)-N-methyl-4-phenylbut-3-enamide is CNC(=O)C/C=C/c1ccccc1.
What is the InChIKey of (E)-N-methyl-4-phenylbut-3-enamide?
The InChIKey is WERDNYMSOFFSAL-VMPITWQZSA-N. The full InChI is InChI=1S/C11H13NO/c1-12-11(13)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3,(H,12,13)/b8-5+.
What are the key properties of (E)-N-methyl-4-phenylbut-3-enamide?
(E)-N-methyl-4-phenylbut-3-enamide has a molecular weight of 175.23 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methyl-4-phenylbut-3-enamide is sourced from PubChem (CID 59663964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).