N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide

C17H15NO3 — CID 175343363

IUPACN-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1C(=O)C=Cc1ccc(O)cc1
InChIInChI=1S/C17H15NO3/c1-12(19)18-16-5-3-2-4-15(16)17(21)11-8-13-6-9-14(20)10-7-13/h2-11,20H,1H3,(H,18,19)
InChIKeyALSVOFUTCGERDM-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.25
Rot. Bonds4

About N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide

N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide (PubChem CID 175343363) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide
PubChem CID175343363
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC NameN-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1C(=O)C=Cc1ccc(O)cc1
InChIInChI=1S/C17H15NO3/c1-12(19)18-16-5-3-2-4-15(16)17(21)11-8-13-6-9-14(20)10-7-13/h2-11,20H,1H3,(H,18,19)
InChIKeyALSVOFUTCGERDM-UHFFFAOYSA-N
XLogP3.25
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-hydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
CID 25861
2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]benzoic acid
CID 127260328
(E)-1-(2-fluorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
CID 10399428
(E)-3-(4-chlorophenyl)-1-[2-(methylamino)phenyl]prop-2-en-1-one
CID 132918811
N-[3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide
CID 8858697
2,2,2-trifluoro-N-[2-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]phenyl]acetamide
CID 141410051
(E)-N-(2-acetamidophenyl)-3-phenylprop-2-enamide
CID 875192
4-(4-hydroxyphenyl)but-3-en-2-one
CID 159706417
1,3-bis(4-hydroxyphenyl)prop-2-en-1-one;3-(4-hydroxyphenyl)-1-phenylprop-2-en-1-one
CID 67873183
(E)-1-(2-chlorophenyl)-3-[4-[(E)-3-(2-chlorophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one
CID 155677993
(E)-1-[2-(methylamino)phenyl]-3-(4-pyrrolidin-1-ylphenyl)prop-2-en-1-one
CID 101387457
2-acetamido-5-[(E)-2-phenylethenyl]benzoic acid
CID 18405742

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide?
The IUPAC name of N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide (CID 175343363) is N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide?
The canonical SMILES for N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide is CC(=O)Nc1ccccc1C(=O)C=Cc1ccc(O)cc1.
What is the InChIKey of N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide?
The InChIKey is ALSVOFUTCGERDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-12(19)18-16-5-3-2-4-15(16)17(21)11-8-13-6-9-14(20)10-7-13/h2-11,20H,1H3,(H,18,19).
What are the key properties of N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide?
N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide has a molecular weight of 281.31 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]acetamide is sourced from PubChem (CID 175343363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).