N-butyl-8-(4-phenylphenyl)octanamide

C24H33NO — CID 152778485

IUPACN-butyl-8-(4-phenylphenyl)octanamide
SMILESCCCCNC(=O)CCCCCCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H33NO/c1-2-3-20-25-24(26)15-11-6-4-5-8-12-21-16-18-23(19-17-21)22-13-9-7-10-14-22/h7,9-10,13-14,16-19H,2-6,8,11-12,15,20H2,1H3,(H,25,26)
InChIKeyHHHZTGQPPFZSPQ-UHFFFAOYSA-N
MW351.53 g/mol
LogP6.15
Rot. Bonds12

About N-butyl-8-(4-phenylphenyl)octanamide

N-butyl-8-(4-phenylphenyl)octanamide (PubChem CID 152778485) has the molecular formula C24H33NO and a molecular weight of 351.53 g/mol. Its IUPAC name is N-butyl-8-(4-phenylphenyl)octanamide.

Molecular Properties

Compound NameN-butyl-8-(4-phenylphenyl)octanamide
PubChem CID152778485
Molecular FormulaC24H33NO
Molecular Weight351.53 g/mol
Exact Mass351.26
IUPAC NameN-butyl-8-(4-phenylphenyl)octanamide
SMILESCCCCNC(=O)CCCCCCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H33NO/c1-2-3-20-25-24(26)15-11-6-4-5-8-12-21-16-18-23(19-17-21)22-13-9-7-10-14-22/h7,9-10,13-14,16-19H,2-6,8,11-12,15,20H2,1H3,(H,25,26)
InChIKeyHHHZTGQPPFZSPQ-UHFFFAOYSA-N
XLogP6.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.53
LogP ≤ 56.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-butyl-8-(4-phenylphenyl)octanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-phenylbutyl)hexanamide
CID 4985988
butanoic acid;N-butyl-5-(4-methylphenyl)pentanamide
CID 178048626
N-ethyl-6-phenylhexanamide
CID 70953257
N-butyl-3-(3-phenylpropylamino)propanamide
CID 109012240
5-[[2-(methylamino)-3-(4-phenylphenyl)propanoyl]amino]-N-pentylpentanamide
CID 171640025
N-butyl-4-(4-chlorophenyl)butanamide
CID 110297621
1-pentadecyl-4-phenylbenzene
CID 57166115
8-(4-phenylbutanoylamino)octanoic acid
CID 71129906
6-oxo-6-(3-phenylpropylamino)hexanoic acid
CID 60913632
4-phenyl-N-(2-phenylethyl)butanamide;propane
CID 143447835
N-hydroxy-6-[[2-(4-phenylphenyl)acetyl]amino]hexanamide
CID 42599942
N-[4-[2-(4-hydroxyphenyl)ethylamino]-4-oxobutyl]docosanamide
CID 59789165

Frequently Asked Questions

What is the IUPAC name of N-butyl-8-(4-phenylphenyl)octanamide?
The IUPAC name of N-butyl-8-(4-phenylphenyl)octanamide (CID 152778485) is N-butyl-8-(4-phenylphenyl)octanamide.
What is the SMILES notation for N-butyl-8-(4-phenylphenyl)octanamide?
The canonical SMILES for N-butyl-8-(4-phenylphenyl)octanamide is CCCCNC(=O)CCCCCCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-butyl-8-(4-phenylphenyl)octanamide?
The InChIKey is HHHZTGQPPFZSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO/c1-2-3-20-25-24(26)15-11-6-4-5-8-12-21-16-18-23(19-17-21)22-13-9-7-10-14-22/h7,9-10,13-14,16-19H,2-6,8,11-12,15,20H2,1H3,(H,25,26).
What are the key properties of N-butyl-8-(4-phenylphenyl)octanamide?
N-butyl-8-(4-phenylphenyl)octanamide has a molecular weight of 351.53 g/mol, XLogP of 6.15, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-8-(4-phenylphenyl)octanamide is sourced from PubChem (CID 152778485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).