N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide

C16H24N2O2 — CID 47287860

IUPACN-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN(C)CCC(C)C
InChIInChI=1S/C16H24N2O2/c1-12(2)9-10-18(4)11-16(20)17-15-8-6-5-7-14(15)13(3)19/h5-8,12H,9-11H2,1-4H3,(H,17,20)
InChIKeyPEAFMIAYDJMVGC-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.81
Rot. Bonds7

About N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide

N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide (PubChem CID 47287860) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide
PubChem CID47287860
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN(C)CCC(C)C
InChIInChI=1S/C16H24N2O2/c1-12(2)9-10-18(4)11-16(20)17-15-8-6-5-7-14(15)13(3)19/h5-8,12H,9-11H2,1-4H3,(H,17,20)
InChIKeyPEAFMIAYDJMVGC-UHFFFAOYSA-N
XLogP2.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-acetylphenyl)-2-[cyclopropyl(2-methylpropyl)amino]acetamide
CID 43065753
N-(2-acetylphenyl)-2-[methyl-[2-(4-methylphenoxy)ethyl]amino]acetamide
CID 26429305
2-[[2-(2-acetylanilino)-2-oxoethyl]-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 9197970
N-(2-acetylphenyl)-2-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]acetamide
CID 9221698
N-(2-acetylphenyl)-2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]acetamide
CID 8586985
N-(2-acetylphenyl)-2-[cyclopropyl(methyl)amino]acetamide
CID 30891872
N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 111488425
2-[3-hydroxybutyl(methyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 115665846
N-(2-aminophenyl)-2-[methyl(2-methylpropyl)amino]acetamide
CID 43271763
N-(2-benzoylphenyl)-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 110880676
2-[(3-amino-4-methylpentyl)-methylamino]-N-(2-methylphenyl)acetamide
CID 81491089
N-(2-acetylphenyl)-2-[(2-chloro-6-fluorophenyl)methyl-methylamino]acetamide
CID 9197428

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide?
The IUPAC name of N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide (CID 47287860) is N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide?
The canonical SMILES for N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide is CC(=O)c1ccccc1NC(=O)CN(C)CCC(C)C.
What is the InChIKey of N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide?
The InChIKey is PEAFMIAYDJMVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)9-10-18(4)11-16(20)17-15-8-6-5-7-14(15)13(3)19/h5-8,12H,9-11H2,1-4H3,(H,17,20).
What are the key properties of N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide?
N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide is sourced from PubChem (CID 47287860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).