N-(2-acetylphenyl)-2-propylpentanamide

C16H23NO2 — CID 113329842

IUPACN-(2-acetylphenyl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)Nc1ccccc1C(C)=O
InChIInChI=1S/C16H23NO2/c1-4-8-13(9-5-2)16(19)17-15-11-7-6-10-14(15)12(3)18/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,17,19)
InChIKeyMSPLNBNBDADXCE-UHFFFAOYSA-N
MW261.37 g/mol
LogP4.04
Rot. Bonds7

About N-(2-acetylphenyl)-2-propylpentanamide

N-(2-acetylphenyl)-2-propylpentanamide (PubChem CID 113329842) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-propylpentanamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-propylpentanamide
PubChem CID113329842
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-(2-acetylphenyl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)Nc1ccccc1C(C)=O
InChIInChI=1S/C16H23NO2/c1-4-8-13(9-5-2)16(19)17-15-11-7-6-10-14(15)12(3)18/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,17,19)
InChIKeyMSPLNBNBDADXCE-UHFFFAOYSA-N
XLogP4.04
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-acetylphenyl)-2-methylpentanamide
CID 43183491
N-(2-bromophenyl)-2-propylpentanamide
CID 115532233
N-(2-methoxyphenyl)-2-propylpentanamide
CID 2995533
2-(2-hexadecylicosanoylamino)benzoic acid
CID 70149182
2-[2-(aminomethyl)pentanoylamino]-N,N-dimethylbenzamide
CID 65226220
(2R)-2-bromo-N-[2-[[[(2R)-2-bromopentanoyl]amino]carbamoyl]phenyl]pentanamide
CID 2302264
3-carboxy-4-(2-propylpentanoylamino)phenolate
CID 54689486
2-(2-ethylbutanoylamino)benzamide
CID 1214109
2-ethyl-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]butanamide
CID 24707294
1-(2-acetylphenyl)-3-propan-2-ylurea
CID 28738066
methyl 2-(2-methylpentanoylamino)benzoate
CID 2904418
N-[2-(3-aminoprop-1-ynyl)phenyl]-2-propylpentanamide
CID 82987618

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-propylpentanamide?
The IUPAC name of N-(2-acetylphenyl)-2-propylpentanamide (CID 113329842) is N-(2-acetylphenyl)-2-propylpentanamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-propylpentanamide?
The canonical SMILES for N-(2-acetylphenyl)-2-propylpentanamide is CCCC(CCC)C(=O)Nc1ccccc1C(C)=O.
What is the InChIKey of N-(2-acetylphenyl)-2-propylpentanamide?
The InChIKey is MSPLNBNBDADXCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-4-8-13(9-5-2)16(19)17-15-11-7-6-10-14(15)12(3)18/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,17,19).
What are the key properties of N-(2-acetylphenyl)-2-propylpentanamide?
N-(2-acetylphenyl)-2-propylpentanamide has a molecular weight of 261.37 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-propylpentanamide is sourced from PubChem (CID 113329842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).