(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide

C16H15NO3 — CID 71559763

IUPAC(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1NC(=O)/C=C/c1cccc(O)c1
InChIInChI=1S/C16H15NO3/c1-20-15-8-3-2-7-14(15)17-16(19)10-9-12-5-4-6-13(18)11-12/h2-11,18H,1H3,(H,17,19)/b10-9+
InChIKeyXSGGJVXCEQZANP-MDZDMXLPSA-N
MW269.30 g/mol
LogP3.05
Rot. Bonds4

About (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide

(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide (PubChem CID 71559763) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide
PubChem CID71559763
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1NC(=O)/C=C/c1cccc(O)c1
InChIInChI=1S/C16H15NO3/c1-20-15-8-3-2-7-14(15)17-16(19)10-9-12-5-4-6-13(18)11-12/h2-11,18H,1H3,(H,17,19)/b10-9+
InChIKeyXSGGJVXCEQZANP-MDZDMXLPSA-N
XLogP3.05
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Benzenepropanamide, N-(2-methoxyphenyl)-beta-oxo-
CID 7079
2',2''-Dimethoxy-4',4''-biacetanilide
CID 54986
N-(4-methoxyphenyl) caffeamide
CID 46861776
Acetamide, N-(2-methoxy-5-methylphenyl)-
CID 81412
8-Methoxy-4-methylquinolin-2(1H)-one
CID 782123
(2E)-4-[(2-methoxyphenyl)amino]-4-oxobut-2-enoic acid
CID 682454
8-hydroxyquinolin-2(1H)-one
CID 97250
4-amino-N-(2-methoxyphenyl)benzamide
CID 2317363
(E)-N-(3-Methoxyphenyl)-3-phenyl-2-propenamide
CID 795596
N-[2-(4-hexyl-2-hydroxyphenoxy)phenyl]acetamide
CID 44450092
N-[4-(3-Methoxy-benzyl)-phenyl]-butyramide
CID 44264818
4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54687734

Frequently Asked Questions

What is the IUPAC name of (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide?
The IUPAC name of (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide (CID 71559763) is (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide.
What is the SMILES notation for (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide?
The canonical SMILES for (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide is COc1ccccc1NC(=O)/C=C/c1cccc(O)c1.
What is the InChIKey of (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide?
The InChIKey is XSGGJVXCEQZANP-MDZDMXLPSA-N. The full InChI is InChI=1S/C16H15NO3/c1-20-15-8-3-2-7-14(15)17-16(19)10-9-12-5-4-6-13(18)11-12/h2-11,18H,1H3,(H,17,19)/b10-9+.
What are the key properties of (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide?
(E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide has a molecular weight of 269.30 g/mol, XLogP of 3.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(3-hydroxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide is sourced from PubChem (CID 71559763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).