(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide

C20H17NO3 — CID 146207373

IUPAC(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide
SMILESCOc1ccc(/C=C/C(=O)NO)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C20H17NO3/c1-24-18-10-8-15(9-11-20(22)21-23)19(13-18)17-7-6-14-4-2-3-5-16(14)12-17/h2-13,23H,1H3,(H,21,22)/b11-9+
InChIKeyZIJPTQJOIMFOGF-PKNBQFBNSA-N
MW319.36 g/mol
LogP4.03
Rot. Bonds4

About (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide

(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide (PubChem CID 146207373) has the molecular formula C20H17NO3 and a molecular weight of 319.36 g/mol. Its IUPAC name is (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide
PubChem CID146207373
Molecular FormulaC20H17NO3
Molecular Weight319.36 g/mol
Exact Mass319.12
IUPAC Name(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide
SMILESCOc1ccc(/C=C/C(=O)NO)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C20H17NO3/c1-24-18-10-8-15(9-11-20(22)21-23)19(13-18)17-7-6-14-4-2-3-5-16(14)12-17/h2-13,23H,1H3,(H,21,22)/b11-9+
InChIKeyZIJPTQJOIMFOGF-PKNBQFBNSA-N
XLogP4.03
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-3-[2-(3-methoxyphenoxy)phenyl]prop-2-enamide
CID 78137677
N-hydroxy-3-naphthalen-2-ylprop-2-enamide
CID 54114861
(E)-3-(2,4-dimethoxyphenyl)-N-[(1S)-1-naphthalen-2-ylethyl]prop-2-enamide
CID 20744202
N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
CID 123173944
(2E,4E)-N-hydroxy-5-[4-(4-methoxyphenyl)phenyl]penta-2,4-dienamide
CID 42631047
methyl (E)-3-(2-acetamido-3-naphthalen-2-ylphenyl)prop-2-enoate
CID 139249331
2-methoxynaphthalene;2-phenylnaphthalene
CID 173269029
2-methoxy-7-(2-phenylphenyl)naphthalene
CID 141340555
naphthalen-2-yl (E)-3-(4-methoxyphenyl)prop-2-enoate
CID 886279
(E)-3-(4-methoxyphenyl)-N'-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]prop-2-enehydrazide
CID 21406103
(E)-3-[3-methoxy-5-(6-methoxynaphthalen-2-yl)phenyl]-N-phenylprop-2-enamide
CID 59443460
(E)-3-(2-hydroxy-4-methoxyphenyl)-N-phenylprop-2-enamide
CID 89317529

Frequently Asked Questions

What is the IUPAC name of (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide?
The IUPAC name of (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide (CID 146207373) is (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide is COc1ccc(/C=C/C(=O)NO)c(-c2ccc3ccccc3c2)c1.
What is the InChIKey of (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide?
The InChIKey is ZIJPTQJOIMFOGF-PKNBQFBNSA-N. The full InChI is InChI=1S/C20H17NO3/c1-24-18-10-8-15(9-11-20(22)21-23)19(13-18)17-7-6-14-4-2-3-5-16(14)12-17/h2-13,23H,1H3,(H,21,22)/b11-9+.
What are the key properties of (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide?
(E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide has a molecular weight of 319.36 g/mol, XLogP of 4.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-hydroxy-3-(4-methoxy-2-naphthalen-2-ylphenyl)prop-2-enamide is sourced from PubChem (CID 146207373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).