N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide

C16H26N2O2 — CID 119643311

IUPACN-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide
SMILESCCC(N)(CC)CNC(=O)COCCc1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-16(17,4-2)13-18-15(19)12-20-11-10-14-8-6-5-7-9-14/h5-9H,3-4,10-13,17H2,1-2H3,(H,18,19)
InChIKeyAEXADJUJOXWNCQ-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.88
Rot. Bonds9

About N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide

N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide (PubChem CID 119643311) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide
PubChem CID119643311
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide
SMILESCCC(N)(CC)CNC(=O)COCCc1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-16(17,4-2)13-18-15(19)12-20-11-10-14-8-6-5-7-9-14/h5-9H,3-4,10-13,17H2,1-2H3,(H,18,19)
InChIKeyAEXADJUJOXWNCQ-UHFFFAOYSA-N
XLogP1.88
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride
CID 119641121
N-(2-amino-2-ethylbutyl)-2-(2-phenylmethoxyphenoxy)acetamide
CID 119643357
N-(2-amino-2-ethylbutyl)-2-butoxyacetamide
CID 119640904
N-(2-aminoethyl)-2-(2-phenylethoxy)acetamide
CID 114988878
N-(2-amino-2-ethylbutyl)-2-ethoxyacetamide;hydrochloride
CID 119642392
N-(2-amino-2-ethylbutyl)-2-pentoxyacetamide;hydrochloride
CID 119639970
2-methyl-2-[[2-(2-phenylethoxy)acetyl]amino]propanoic acid
CID 119187691
N-(2-amino-2-ethylbutyl)-2-(2-phenylphenoxy)acetamide
CID 119640180
N-(2-amino-2-ethylbutyl)-2-(2-chlorophenoxy)acetamide
CID 119641891
N-(2-amino-2-ethylbutyl)-2-naphthalen-2-yloxyacetamide
CID 119639639
N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide
CID 119641906
4-methyl-4-[[2-(2-phenylethoxy)acetyl]amino]pentanoic acid
CID 119204238

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide (CID 119643311) is N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide is CCC(N)(CC)CNC(=O)COCCc1ccccc1.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide?
The InChIKey is AEXADJUJOXWNCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-16(17,4-2)13-18-15(19)12-20-11-10-14-8-6-5-7-9-14/h5-9H,3-4,10-13,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide?
N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide has a molecular weight of 278.40 g/mol, XLogP of 1.88, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide is sourced from PubChem (CID 119643311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).