2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide

C15H24N2O2 — CID 61106876

IUPAC2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide
SMILESCC(N(C)C(=O)COc1ccccc1N)C(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-11(15(2,3)4)17(5)14(18)10-19-13-9-7-6-8-12(13)16/h6-9,11H,10,16H2,1-5H3
InChIKeyUSNODLOVCHROQK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.54
Rot. Bonds4

About 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide

2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide (PubChem CID 61106876) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide
PubChem CID61106876
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide
SMILESCC(N(C)C(=O)COc1ccccc1N)C(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-11(15(2,3)4)17(5)14(18)10-19-13-9-7-6-8-12(13)16/h6-9,11H,10,16H2,1-5H3
InChIKeyUSNODLOVCHROQK-UHFFFAOYSA-N
XLogP2.54
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.54
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

2-(2-aminophenoxy)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 61109635
2-(2-aminophenoxy)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
CID 63693890
3-(2-aminophenoxy)-N-(1-hydroxypropan-2-yl)-N-methylpropanamide
CID 113425868
3-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)propanamide
CID 104827234
2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N,N-diethylacetamide
CID 61108210
2-(2-ethoxyphenoxy)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 112704674
2-[2-[(tert-butylamino)methyl]phenoxy]-N-methyl-N-propan-2-ylacetamide
CID 63063750
2-(2-aminophenoxy)-N-methyl-N-(3-methylphenyl)acetamide
CID 62003692
methyl 3-(2-aminophenoxy)-2,2-dimethylpropanoate
CID 79622163
2-ethoxyaniline;propan-2-one
CID 517004
2-(2-aminophenoxy)-N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]acetamide
CID 64511151
N-butan-2-yl-2-(2-ethylphenoxy)-N-methylacetamide
CID 78853919

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide?
The IUPAC name of 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide (CID 61106876) is 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide.
What is the SMILES notation for 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide?
The canonical SMILES for 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide is CC(N(C)C(=O)COc1ccccc1N)C(C)(C)C.
What is the InChIKey of 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide?
The InChIKey is USNODLOVCHROQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(15(2,3)4)17(5)14(18)10-19-13-9-7-6-8-12(13)16/h6-9,11H,10,16H2,1-5H3.
What are the key properties of 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide?
2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide has a molecular weight of 264.37 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide is sourced from PubChem (CID 61106876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).