N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide

C15H24N2O2 — CID 107158440

IUPACN-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide
SMILESCC(C)(C)CC(N)CNC(=O)COc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-15(2,3)9-12(16)10-17-14(18)11-19-13-7-5-4-6-8-13/h4-8,12H,9-11,16H2,1-3H3,(H,17,18)
InChIKeyQNKZBUFGJRIYJS-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.95
Rot. Bonds6

About N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide

N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide (PubChem CID 107158440) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide
PubChem CID107158440
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide
SMILESCC(C)(C)CC(N)CNC(=O)COc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-15(2,3)9-12(16)10-17-14(18)11-19-13-7-5-4-6-8-13/h4-8,12H,9-11,16H2,1-3H3,(H,17,18)
InChIKeyQNKZBUFGJRIYJS-UHFFFAOYSA-N
XLogP1.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylbutyl)-2-phenoxyacetamide
CID 115612512
methyl 2-bromo-3-[(2-phenoxyacetyl)amino]propanoate
CID 103492482
N-(3-hydroxy-2-methylpropyl)-2-phenoxyacetamide
CID 65032139
N-[2,2-dimethyl-3-(methylamino)propyl]-2-phenoxyacetamide
CID 115267300
N-(2-methylpropyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]acetamide
CID 19170892
N-(4-bromo-2-methylbutyl)-2-phenoxyacetamide
CID 114316800
N-(2-amino-2-phenylethyl)-2-(4-ethoxyphenoxy)acetamide;hydrochloride
CID 119528609
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
N-(2-hydroxy-2-methylbutyl)-2-phenoxyacetamide
CID 65114465
N-(2,3-dihydroxy-2-methylpropyl)-2-phenoxyacetamide
CID 66169825
N-(3-aminobutyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 119497991
N-(3-methylbutyl)-2-phenoxyacetamide
CID 2905656

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide?
The IUPAC name of N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide (CID 107158440) is N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide is CC(C)(C)CC(N)CNC(=O)COc1ccccc1.
What is the InChIKey of N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide?
The InChIKey is QNKZBUFGJRIYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2,3)9-12(16)10-17-14(18)11-19-13-7-5-4-6-8-13/h4-8,12H,9-11,16H2,1-3H3,(H,17,18).
What are the key properties of N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide?
N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide has a molecular weight of 264.37 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide is sourced from PubChem (CID 107158440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).