2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide

C15H24N2O2 — CID 65216731

IUPAC2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1cc(C)c(N)cc1C(C)C
InChIInChI=1S/C15H24N2O2/c1-6-17(5)15(18)9-19-14-7-11(4)13(16)8-12(14)10(2)3/h7-8,10H,6,9,16H2,1-5H3
InChIKeyVHYVVIZIMCZICG-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.56
Rot. Bonds5

About 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide

2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide (PubChem CID 65216731) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide
PubChem CID65216731
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1cc(C)c(N)cc1C(C)C
InChIInChI=1S/C15H24N2O2/c1-6-17(5)15(18)9-19-14-7-11(4)13(16)8-12(14)10(2)3/h7-8,10H,6,9,16H2,1-5H3
InChIKeyVHYVVIZIMCZICG-UHFFFAOYSA-N
XLogP2.56
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(methoxymethoxy)-2-methyl-5-propan-2-ylaniline
CID 65365399
2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-(3-methylbutyl)acetamide
CID 65216681
4-[3-(dimethylamino)propoxy]-2-methyl-5-propan-2-ylaniline
CID 114524620
4-(2,2-difluoroethoxy)-2-methyl-5-propan-2-ylaniline
CID 65216740
2-[2-[(1S)-1-aminoethyl]-4-methylphenoxy]-N-ethyl-N-methylacetamide
CID 55188481
2-(2-amino-4-bromo-6-methylphenoxy)-N-ethyl-N-methylacetamide
CID 79843874
2-(4-amino-2-chlorophenoxy)-N-ethyl-N-methylacetamide
CID 43309382
2-[4-bromo-2-[(1S)-1-hydroxyethyl]phenoxy]-N-ethyl-N-methylacetamide
CID 78932238
2-[5-bromo-2-[1-(ethylamino)ethyl]phenoxy]-N-ethyl-N-methylacetamide
CID 102947741
5-(4-amino-5-methyl-2-propan-2-ylphenoxy)pentan-1-ol
CID 65216687
2-(2-amino-5-methoxyphenoxy)-N-ethyl-N-methylacetamide
CID 102702283
4-ethoxy-2-methyl-5-propan-2-ylbenzamide
CID 82266051

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide?
The IUPAC name of 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide (CID 65216731) is 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide is CCN(C)C(=O)COc1cc(C)c(N)cc1C(C)C.
What is the InChIKey of 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide?
The InChIKey is VHYVVIZIMCZICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-6-17(5)15(18)9-19-14-7-11(4)13(16)8-12(14)10(2)3/h7-8,10H,6,9,16H2,1-5H3.
What are the key properties of 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide?
2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide has a molecular weight of 264.37 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-5-methyl-2-propan-2-ylphenoxy)-N-ethyl-N-methylacetamide is sourced from PubChem (CID 65216731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).