4-dec-1-enyl-N-phenylmethoxybenzamide

C24H31NO2 — CID 54438023

IUPAC4-dec-1-enyl-N-phenylmethoxybenzamide
SMILESCCCCCCCCC=Cc1ccc(C(=O)NOCc2ccccc2)cc1
InChIInChI=1S/C24H31NO2/c1-2-3-4-5-6-7-8-10-13-21-16-18-23(19-17-21)24(26)25-27-20-22-14-11-9-12-15-22/h9-19H,2-8,20H2,1H3,(H,25,26)
InChIKeyWMCGFODLPISHGA-UHFFFAOYSA-N
MW365.52 g/mol
LogP6.31
Rot. Bonds12

About 4-dec-1-enyl-N-phenylmethoxybenzamide

4-dec-1-enyl-N-phenylmethoxybenzamide (PubChem CID 54438023) has the molecular formula C24H31NO2 and a molecular weight of 365.52 g/mol. Its IUPAC name is 4-dec-1-enyl-N-phenylmethoxybenzamide.

Molecular Properties

Compound Name4-dec-1-enyl-N-phenylmethoxybenzamide
PubChem CID54438023
Molecular FormulaC24H31NO2
Molecular Weight365.52 g/mol
Exact Mass365.24
IUPAC Name4-dec-1-enyl-N-phenylmethoxybenzamide
SMILESCCCCCCCCC=Cc1ccc(C(=O)NOCc2ccccc2)cc1
InChIInChI=1S/C24H31NO2/c1-2-3-4-5-6-7-8-10-13-21-16-18-23(19-17-21)24(26)25-27-20-22-14-11-9-12-15-22/h9-19H,2-8,20H2,1H3,(H,25,26)
InChIKeyWMCGFODLPISHGA-UHFFFAOYSA-N
XLogP6.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.52
LogP ≤ 56.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-non-1-enyl]benzoic acid
CID 19834795
oct-1-enylbenzene;phosphoric acid
CID 159316508
4-[[4-[(E)-dec-1-enyl]benzoyl]amino]butanoic acid
CID 70541790
[(E)-octadec-1-enyl]benzene
CID 22722345
N-phenylmethoxyhexanamide
CID 60717350
4-hexoxy-3-methoxy-N-phenylmethoxybenzamide
CID 55338649
[(Z)-octadec-9-enyl]-phenylmethoxyphosphinic acid
CID 139947168
4-phenyl-N-phenylmethoxybenzamide
CID 9227272
4-bromo-N-phenylmethoxybenzamide
CID 41450559
4-(diethylaminomethyl)-N-phenylmethoxybenzamide
CID 38036519
4-[[2-(4-non-1-enylphenyl)-2-oxoethoxy]amino]butanoic acid
CID 57265083
4-[[2-(4-dec-1-enylphenyl)-2-oxoethoxy]amino]butanoic acid
CID 173360363

Frequently Asked Questions

What is the IUPAC name of 4-dec-1-enyl-N-phenylmethoxybenzamide?
The IUPAC name of 4-dec-1-enyl-N-phenylmethoxybenzamide (CID 54438023) is 4-dec-1-enyl-N-phenylmethoxybenzamide.
What is the SMILES notation for 4-dec-1-enyl-N-phenylmethoxybenzamide?
The canonical SMILES for 4-dec-1-enyl-N-phenylmethoxybenzamide is CCCCCCCCC=Cc1ccc(C(=O)NOCc2ccccc2)cc1.
What is the InChIKey of 4-dec-1-enyl-N-phenylmethoxybenzamide?
The InChIKey is WMCGFODLPISHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31NO2/c1-2-3-4-5-6-7-8-10-13-21-16-18-23(19-17-21)24(26)25-27-20-22-14-11-9-12-15-22/h9-19H,2-8,20H2,1H3,(H,25,26).
What are the key properties of 4-dec-1-enyl-N-phenylmethoxybenzamide?
4-dec-1-enyl-N-phenylmethoxybenzamide has a molecular weight of 365.52 g/mol, XLogP of 6.31, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dec-1-enyl-N-phenylmethoxybenzamide is sourced from PubChem (CID 54438023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).