N,N-dimethyl-8-oxo-8-phenyloctanamide

C16H23NO2 — CID 58982119

IUPACN,N-dimethyl-8-oxo-8-phenyloctanamide
SMILESCN(C)C(=O)CCCCCCC(=O)c1ccccc1
InChIInChI=1S/C16H23NO2/c1-17(2)16(19)13-9-4-3-8-12-15(18)14-10-6-5-7-11-14/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3
InChIKeyXINGGPKOGOKZIF-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.30
Rot. Bonds8

About N,N-dimethyl-8-oxo-8-phenyloctanamide

N,N-dimethyl-8-oxo-8-phenyloctanamide (PubChem CID 58982119) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N,N-dimethyl-8-oxo-8-phenyloctanamide.

Molecular Properties

Compound NameN,N-dimethyl-8-oxo-8-phenyloctanamide
PubChem CID58982119
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN,N-dimethyl-8-oxo-8-phenyloctanamide
SMILESCN(C)C(=O)CCCCCCC(=O)c1ccccc1
InChIInChI=1S/C16H23NO2/c1-17(2)16(19)13-9-4-3-8-12-15(18)14-10-6-5-7-11-14/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3
InChIKeyXINGGPKOGOKZIF-UHFFFAOYSA-N
XLogP3.30
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,15-diphenylpentadecane-1,15-dione
CID 159981687
17-(dimethylamino)-1-phenylheptadecan-1-one;hydrobromide
CID 175178049
1-phenylheptadecan-1-one
CID 577626
1-phenyloctadecane-1,17-dione
CID 70545901
1-phenyldodecane-1,11-dione
CID 13147766
N,N-dimethyl-4-oxo-4-(4-phenylphenyl)butanamide
CID 154274689
1-phenylheptane-1,6-dione
CID 11333176
12-hydroxy-1-phenyldodecan-1-one
CID 11482778
N,N-dimethyl-6-phenoxyhexanamide
CID 142596913
18-methyl-1-phenylnonadecan-1-one
CID 141198244
4-[cyclopropyl(methyl)amino]-1-phenylbutan-1-one
CID 43792894
N,N-dimethyl-7-oxo-7-(4-phenylphenyl)heptanamide;5-methyl-3H-1,3,4-thiadiazole-2-thione
CID 91292210

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-8-oxo-8-phenyloctanamide?
The IUPAC name of N,N-dimethyl-8-oxo-8-phenyloctanamide (CID 58982119) is N,N-dimethyl-8-oxo-8-phenyloctanamide.
What is the SMILES notation for N,N-dimethyl-8-oxo-8-phenyloctanamide?
The canonical SMILES for N,N-dimethyl-8-oxo-8-phenyloctanamide is CN(C)C(=O)CCCCCCC(=O)c1ccccc1.
What is the InChIKey of N,N-dimethyl-8-oxo-8-phenyloctanamide?
The InChIKey is XINGGPKOGOKZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-17(2)16(19)13-9-4-3-8-12-15(18)14-10-6-5-7-11-14/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3.
What are the key properties of N,N-dimethyl-8-oxo-8-phenyloctanamide?
N,N-dimethyl-8-oxo-8-phenyloctanamide has a molecular weight of 261.37 g/mol, XLogP of 3.30, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-8-oxo-8-phenyloctanamide is sourced from PubChem (CID 58982119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).