N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide

C16H15NO3 — CID 69127158

IUPACN-(3-methoxyphenyl)-3-phenoxyprop-2-enamide
SMILESCOc1cccc(NC(=O)C=COc2ccccc2)c1
InChIInChI=1S/C16H15NO3/c1-19-15-9-5-6-13(12-15)17-16(18)10-11-20-14-7-3-2-4-8-14/h2-12H,1H3,(H,17,18)
InChIKeyFUKPZMQZCYWJNY-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.23
Rot. Bonds5

About N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide

N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide (PubChem CID 69127158) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-3-phenoxyprop-2-enamide
PubChem CID69127158
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC NameN-(3-methoxyphenyl)-3-phenoxyprop-2-enamide
SMILESCOc1cccc(NC(=O)C=COc2ccccc2)c1
InChIInChI=1S/C16H15NO3/c1-19-15-9-5-6-13(12-15)17-16(18)10-11-20-14-7-3-2-4-8-14/h2-12H,1H3,(H,17,18)
InChIKeyFUKPZMQZCYWJNY-UHFFFAOYSA-N
XLogP3.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxyphenyl)prop-2-enamide
CID 4069606
(E)-4-[4-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylanilino]-4-oxobut-2-enoic acid
CID 22786142
(E)-3-(4-tert-butylphenyl)-N-(3-methoxyphenyl)prop-2-enamide
CID 6146604
methane;N-(3-methoxyphenyl)acetamide
CID 161026095
3-(2,4-dichlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide
CID 868727
methyl 3-phenoxyprop-2-enoate
CID 74041310
N'-(3-methoxyphenyl)-N-(4-phenoxyphenyl)oxamide
CID 44999403
2-hydroxy-N-(3-methoxyphenyl)-2,2-diphenylacetamide
CID 828005
(E)-N-(3,5-dimethoxyphenyl)-3-phenylprop-2-enamide
CID 874970
(E)-3-[4-(difluoromethoxy)phenyl]-N-(3-methoxyphenyl)prop-2-enamide
CID 2654528
2-hydroxy-N-(3-methoxyphenyl)-2-phenylacetamide
CID 82132314
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide?
The IUPAC name of N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide (CID 69127158) is N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide.
What is the SMILES notation for N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide?
The canonical SMILES for N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide is COc1cccc(NC(=O)C=COc2ccccc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide?
The InChIKey is FUKPZMQZCYWJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-19-15-9-5-6-13(12-15)17-16(18)10-11-20-14-7-3-2-4-8-14/h2-12H,1H3,(H,17,18).
What are the key properties of N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide?
N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide has a molecular weight of 269.30 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-3-phenoxyprop-2-enamide is sourced from PubChem (CID 69127158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).