2-ethyl-N-(2-phenoxyphenyl)non-7-enamide

C23H29NO2 — CID 140646561

IUPAC2-ethyl-N-(2-phenoxyphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C23H29NO2/c1-3-5-6-7-9-14-19(4-2)23(25)24-21-17-12-13-18-22(21)26-20-15-10-8-11-16-20/h3,5,8,10-13,15-19H,4,6-7,9,14H2,1-2H3,(H,24,25)
InChIKeyCZWIZAUQUFHDHA-UHFFFAOYSA-N
MW351.49 g/mol
LogP6.58
Rot. Bonds10

About 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide

2-ethyl-N-(2-phenoxyphenyl)non-7-enamide (PubChem CID 140646561) has the molecular formula C23H29NO2 and a molecular weight of 351.49 g/mol. Its IUPAC name is 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide.

Molecular Properties

Compound Name2-ethyl-N-(2-phenoxyphenyl)non-7-enamide
PubChem CID140646561
Molecular FormulaC23H29NO2
Molecular Weight351.49 g/mol
Exact Mass351.22
IUPAC Name2-ethyl-N-(2-phenoxyphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C23H29NO2/c1-3-5-6-7-9-14-19(4-2)23(25)24-21-17-12-13-18-22(21)26-20-15-10-8-11-16-20/h3,5,8,10-13,15-19H,4,6-7,9,14H2,1-2H3,(H,24,25)
InChIKeyCZWIZAUQUFHDHA-UHFFFAOYSA-N
XLogP6.58
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.49
LogP ≤ 56.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromophenyl)-2-ethylnon-7-enamide
CID 140646551
2-ethyl-N-(2-propylphenyl)non-7-enamide
CID 140646559
2-ethyl-N-(4-phenylphenyl)non-7-enamide
CID 150409330
benzyl 2-ethylnon-7-enoate
CID 151050476
N-(2-phenoxyphenyl)decanamide
CID 4091110
2-ethyl-N-[4-(trifluoromethyl)phenyl]non-7-enamide
CID 150634098
4-amino-2-methyl-N-(2-phenoxyphenyl)butanamide
CID 80541383
N-(2-phenoxyphenyl)-2-phenylpropanamide
CID 2933761
2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)butanamide
CID 21173380
[(2R)-1-oxo-1-(2-phenoxyanilino)-3-phenylpropan-2-yl]azanium
CID 6941208
1-butyl-3-(2-phenoxyphenyl)urea
CID 604054
(2R)-2-(3-methylphenoxy)-N-(2-phenoxyphenyl)butanamide
CID 28573798

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide?
The IUPAC name of 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide (CID 140646561) is 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide.
What is the SMILES notation for 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide?
The canonical SMILES for 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide is CC=CCCCCC(CC)C(=O)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide?
The InChIKey is CZWIZAUQUFHDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO2/c1-3-5-6-7-9-14-19(4-2)23(25)24-21-17-12-13-18-22(21)26-20-15-10-8-11-16-20/h3,5,8,10-13,15-19H,4,6-7,9,14H2,1-2H3,(H,24,25).
What are the key properties of 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide?
2-ethyl-N-(2-phenoxyphenyl)non-7-enamide has a molecular weight of 351.49 g/mol, XLogP of 6.58, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-phenoxyphenyl)non-7-enamide is sourced from PubChem (CID 140646561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).