2-ethyl-N-(4-phenylphenyl)non-7-enamide

C23H29NO — CID 150409330

IUPAC2-ethyl-N-(4-phenylphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H29NO/c1-3-5-6-7-9-12-19(4-2)23(25)24-22-17-15-21(16-18-22)20-13-10-8-11-14-20/h3,5,8,10-11,13-19H,4,6-7,9,12H2,1-2H3,(H,24,25)
InChIKeyHFLJIOSPLFWTPU-UHFFFAOYSA-N
MW335.49 g/mol
LogP6.45
Rot. Bonds9

About 2-ethyl-N-(4-phenylphenyl)non-7-enamide

2-ethyl-N-(4-phenylphenyl)non-7-enamide (PubChem CID 150409330) has the molecular formula C23H29NO and a molecular weight of 335.49 g/mol. Its IUPAC name is 2-ethyl-N-(4-phenylphenyl)non-7-enamide.

Molecular Properties

Compound Name2-ethyl-N-(4-phenylphenyl)non-7-enamide
PubChem CID150409330
Molecular FormulaC23H29NO
Molecular Weight335.49 g/mol
Exact Mass335.22
IUPAC Name2-ethyl-N-(4-phenylphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H29NO/c1-3-5-6-7-9-12-19(4-2)23(25)24-22-17-15-21(16-18-22)20-13-10-8-11-14-20/h3,5,8,10-11,13-19H,4,6-7,9,12H2,1-2H3,(H,24,25)
InChIKeyHFLJIOSPLFWTPU-UHFFFAOYSA-N
XLogP6.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.49
LogP ≤ 56.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

2-ethyl-N-[4-(trifluoromethyl)phenyl]non-7-enamide
CID 150634098
N-(2-bromophenyl)-2-ethylnon-7-enamide
CID 140646551
2-ethyl-N-(2-propylphenyl)non-7-enamide
CID 140646559
2-ethyl-N-(2-phenoxyphenyl)non-7-enamide
CID 140646561
2-(aminomethyl)-N-(4-phenylphenyl)butanamide
CID 62254928
(E)-2-ethyl-N-[(4-methylphenyl)methyl]non-7-enamide
CID 90266134
benzyl 2-ethylnon-7-enoate
CID 151050476
2-ethyl-N-(4-fluorophenyl)heptanamide
CID 130290912
(2S)-2-ethyl-N-(4-phenylmethoxyphenyl)hexanamide
CID 40547684
2-(carboxymethylamino)acetic acid;2-ethyl-N-phenylbutanamide
CID 67945076
5-amino-2-methyl-N-(4-phenylphenyl)pentanamide
CID 104683998
N-benzyl-4-(2-ethylhexanoylamino)benzamide
CID 546715

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(4-phenylphenyl)non-7-enamide?
The IUPAC name of 2-ethyl-N-(4-phenylphenyl)non-7-enamide (CID 150409330) is 2-ethyl-N-(4-phenylphenyl)non-7-enamide.
What is the SMILES notation for 2-ethyl-N-(4-phenylphenyl)non-7-enamide?
The canonical SMILES for 2-ethyl-N-(4-phenylphenyl)non-7-enamide is CC=CCCCCC(CC)C(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-ethyl-N-(4-phenylphenyl)non-7-enamide?
The InChIKey is HFLJIOSPLFWTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO/c1-3-5-6-7-9-12-19(4-2)23(25)24-22-17-15-21(16-18-22)20-13-10-8-11-14-20/h3,5,8,10-11,13-19H,4,6-7,9,12H2,1-2H3,(H,24,25).
What are the key properties of 2-ethyl-N-(4-phenylphenyl)non-7-enamide?
2-ethyl-N-(4-phenylphenyl)non-7-enamide has a molecular weight of 335.49 g/mol, XLogP of 6.45, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(4-phenylphenyl)non-7-enamide is sourced from PubChem (CID 150409330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).