2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide

C15H22N2O2 — CID 62057785

IUPAC2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)COc1c(C)cc(C)cc1N)C1CC1
InChIInChI=1S/C15H22N2O2/c1-4-17(12-5-6-12)14(18)9-19-15-11(3)7-10(2)8-13(15)16/h7-8,12H,4-6,9,16H2,1-3H3
InChIKeyNRJIOHVNVUEBHH-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.28
Rot. Bonds5

About 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide

2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide (PubChem CID 62057785) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide.

Molecular Properties

Compound Name2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide
PubChem CID62057785
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)COc1c(C)cc(C)cc1N)C1CC1
InChIInChI=1S/C15H22N2O2/c1-4-17(12-5-6-12)14(18)9-19-15-11(3)7-10(2)8-13(15)16/h7-8,12H,4-6,9,16H2,1-3H3
InChIKeyNRJIOHVNVUEBHH-UHFFFAOYSA-N
XLogP2.28
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.28
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-amino-4-methylphenoxy)-N-cyclopropyl-N-ethylacetamide
CID 54957478
N-cyclopropyl-N-ethyl-2-(4-formyl-2,6-dimethylphenoxy)acetamide
CID 61488385
N-cyclopropyl-N-(2-hydroxyethyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 43576640
2-(2-amino-5-methylphenoxy)-N-cyclopropyl-N-ethylacetamide
CID 54957324
2-(2-amino-6-bromo-4-fluorophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 61488078
2-(2-amino-6-bromo-4-chlorophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 61488077
N-cyclopropyl-N-ethyl-2-(2-formyl-6-methylphenoxy)acetamide
CID 112611155
[2-[cyclopropyl(ethyl)amino]-2-oxoethyl] 3-amino-4-methylbenzoate
CID 61488844
2-(2-amino-4-bromophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 65431648
N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64854538
N-cyclopropyl-N-ethyl-2-(4-fluoro-3-methylphenoxy)acetamide
CID 81421978
2-(2-amino-4-bromo-6-methylphenoxy)-N-ethyl-N-methylacetamide
CID 79843874

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide?
The IUPAC name of 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide (CID 62057785) is 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide.
What is the SMILES notation for 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide?
The canonical SMILES for 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide is CCN(C(=O)COc1c(C)cc(C)cc1N)C1CC1.
What is the InChIKey of 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide?
The InChIKey is NRJIOHVNVUEBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-17(12-5-6-12)14(18)9-19-15-11(3)7-10(2)8-13(15)16/h7-8,12H,4-6,9,16H2,1-3H3.
What are the key properties of 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide?
2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide has a molecular weight of 262.35 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4,6-dimethylphenoxy)-N-cyclopropyl-N-ethylacetamide is sourced from PubChem (CID 62057785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).