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

C20H31NO — CID 140646559

IUPAC2-ethyl-N-(2-propylphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccccc1CCC
InChIInChI=1S/C20H31NO/c1-4-7-8-9-10-14-17(6-3)20(22)21-19-16-12-11-15-18(19)13-5-2/h4,7,11-12,15-17H,5-6,8-10,13-14H2,1-3H3,(H,21,22)
InChIKeyXWFDGUIFDWCHAA-UHFFFAOYSA-N
MW301.47 g/mol
LogP5.74
Rot. Bonds10

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

2-ethyl-N-(2-propylphenyl)non-7-enamide (PubChem CID 140646559) has the molecular formula C20H31NO and a molecular weight of 301.47 g/mol. Its IUPAC name is 2-ethyl-N-(2-propylphenyl)non-7-enamide.

Molecular Properties

Compound Name2-ethyl-N-(2-propylphenyl)non-7-enamide
PubChem CID140646559
Molecular FormulaC20H31NO
Molecular Weight301.47 g/mol
Exact Mass301.24
IUPAC Name2-ethyl-N-(2-propylphenyl)non-7-enamide
SMILESCC=CCCCCC(CC)C(=O)Nc1ccccc1CCC
InChIInChI=1S/C20H31NO/c1-4-7-8-9-10-14-17(6-3)20(22)21-19-16-12-11-15-18(19)13-5-2/h4,7,11-12,15-17H,5-6,8-10,13-14H2,1-3H3,(H,21,22)
InChIKeyXWFDGUIFDWCHAA-UHFFFAOYSA-N
XLogP5.74
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.47
LogP ≤ 55.74
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

N-(2-bromophenyl)-2-ethylnon-7-enamide
CID 140646551
2-ethyl-N-(2-phenoxyphenyl)non-7-enamide
CID 140646561
2-ethyl-N-(4-phenylphenyl)non-7-enamide
CID 150409330
2-ethyl-N-[4-(trifluoromethyl)phenyl]non-7-enamide
CID 150634098
4-amino-2-ethyl-N-(2-ethylphenyl)butanamide
CID 112515504
2-ethyl-N-naphthalen-1-ylhexanamide
CID 3580350
(E)-2-ethyl-N-[(4-methylphenyl)methyl]non-7-enamide
CID 90266134
benzyl 2-ethylnon-7-enoate
CID 151050476
(2R)-2-amino-3,3-dimethyl-N-(2-propylphenyl)butanamide
CID 103928701
(2S)-2-ethyl-N-[2-(trifluoromethyl)phenyl]hexanamide
CID 7321292
ethane;N-(2-propylphenyl)acetamide
CID 142804217
2-[5-[2-(2-ethylbutanoylamino)phenyl]pentyl]benzoic acid
CID 68688439

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-propylphenyl)non-7-enamide?
The IUPAC name of 2-ethyl-N-(2-propylphenyl)non-7-enamide (CID 140646559) is 2-ethyl-N-(2-propylphenyl)non-7-enamide.
What is the SMILES notation for 2-ethyl-N-(2-propylphenyl)non-7-enamide?
The canonical SMILES for 2-ethyl-N-(2-propylphenyl)non-7-enamide is CC=CCCCCC(CC)C(=O)Nc1ccccc1CCC.
What is the InChIKey of 2-ethyl-N-(2-propylphenyl)non-7-enamide?
The InChIKey is XWFDGUIFDWCHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO/c1-4-7-8-9-10-14-17(6-3)20(22)21-19-16-12-11-15-18(19)13-5-2/h4,7,11-12,15-17H,5-6,8-10,13-14H2,1-3H3,(H,21,22).
What are the key properties of 2-ethyl-N-(2-propylphenyl)non-7-enamide?
2-ethyl-N-(2-propylphenyl)non-7-enamide has a molecular weight of 301.47 g/mol, XLogP of 5.74, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-propylphenyl)non-7-enamide is sourced from PubChem (CID 140646559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).