N-[(E)-3-phenylprop-2-enyl]acetamide

C11H13NO — CID 10035108

IUPACN-[(E)-3-phenylprop-2-enyl]acetamide
SMILESCC(=O)NC/C=C/c1ccccc1
InChIInChI=1S/C11H13NO/c1-10(13)12-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3,(H,12,13)/b8-5+
InChIKeyIQIJIAHSHBJYCO-VMPITWQZSA-N
MW175.23 g/mol
LogP1.84
Rot. Bonds3

About N-[(E)-3-phenylprop-2-enyl]acetamide

N-[(E)-3-phenylprop-2-enyl]acetamide (PubChem CID 10035108) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is N-[(E)-3-phenylprop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[(E)-3-phenylprop-2-enyl]acetamide
PubChem CID10035108
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC NameN-[(E)-3-phenylprop-2-enyl]acetamide
SMILESCC(=O)NC/C=C/c1ccccc1
InChIInChI=1S/C11H13NO/c1-10(13)12-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3,(H,12,13)/b8-5+
InChIKeyIQIJIAHSHBJYCO-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 N-[(E)-3-phenylprop-2-enyl]acetamide?
The IUPAC name of N-[(E)-3-phenylprop-2-enyl]acetamide (CID 10035108) is N-[(E)-3-phenylprop-2-enyl]acetamide.
What is the SMILES notation for N-[(E)-3-phenylprop-2-enyl]acetamide?
The canonical SMILES for N-[(E)-3-phenylprop-2-enyl]acetamide is CC(=O)NC/C=C/c1ccccc1.
What is the InChIKey of N-[(E)-3-phenylprop-2-enyl]acetamide?
The InChIKey is IQIJIAHSHBJYCO-VMPITWQZSA-N. The full InChI is InChI=1S/C11H13NO/c1-10(13)12-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3,(H,12,13)/b8-5+.
What are the key properties of N-[(E)-3-phenylprop-2-enyl]acetamide?
N-[(E)-3-phenylprop-2-enyl]acetamide 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 N-[(E)-3-phenylprop-2-enyl]acetamide is sourced from PubChem (CID 10035108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).