N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide

C16H15NO3 — CID 135290524

IUPACN-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H15NO3/c1-3-16(18)17-12-4-6-14(7-5-12)20-15-10-8-13(19-2)9-11-15/h3-11H,1H2,2H3,(H,17,18)
InChIKeyFXQPGEFQVWFULV-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.61
Rot. Bonds5

About N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide

N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide (PubChem CID 135290524) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide
PubChem CID135290524
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC NameN-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H15NO3/c1-3-16(18)17-12-4-6-14(7-5-12)20-15-10-8-13(19-2)9-11-15/h3-11H,1H2,2H3,(H,17,18)
InChIKeyFXQPGEFQVWFULV-UHFFFAOYSA-N
XLogP3.61
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 ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-methoxyphenyl)-4-(prop-2-enoylamino)benzamide
CID 166403507
N-[4-[4-(1,1-difluoroethyl)phenoxy]phenyl]prop-2-enamide
CID 135302300
N-(4-propan-2-yloxyphenyl)prop-2-enamide
CID 43616366
N-(3-methoxyphenyl)prop-2-enamide
CID 4069606
N-(4-methoxyphenyl)-N'-(4-phenoxyphenyl)oxamide
CID 44995857
[4-(prop-2-enoylamino)phenyl]mercury
CID 67534138
1,3-bis(4-methoxyphenyl)urea
CID 139045428
(E)-N-(4-methoxyphenyl)-4-methylpent-2-enamide
CID 127125735
[4-(prop-2-enoylamino)phenyl] 2-bromo-2-methylpropanoate
CID 102031609
N-[4-(4-ethoxyanilino)phenyl]prop-2-enamide
CID 19795365
N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CID 167861168
N-[4-[3-(3,5-difluorophenyl)phenoxy]phenyl]prop-2-enamide
CID 139520074

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide?
The IUPAC name of N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide (CID 135290524) is N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide.
What is the SMILES notation for N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide?
The canonical SMILES for N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide is C=CC(=O)Nc1ccc(Oc2ccc(OC)cc2)cc1.
What is the InChIKey of N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide?
The InChIKey is FXQPGEFQVWFULV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-3-16(18)17-12-4-6-14(7-5-12)20-15-10-8-13(19-2)9-11-15/h3-11H,1H2,2H3,(H,17,18).
What are the key properties of N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide?
N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide has a molecular weight of 269.30 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methoxyphenoxy)phenyl]prop-2-enamide is sourced from PubChem (CID 135290524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).