N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide

C15H24N2O2 — CID 62639499

IUPACN-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide
SMILESCNC(C)C(=O)N(C)CCOc1cc(C)cc(C)c1
InChIInChI=1S/C15H24N2O2/c1-11-8-12(2)10-14(9-11)19-7-6-17(5)15(18)13(3)16-4/h8-10,13,16H,6-7H2,1-5H3
InChIKeyHSNZUQUEUSIMQR-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.75
Rot. Bonds6

About N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide

N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide (PubChem CID 62639499) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide
PubChem CID62639499
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide
SMILESCNC(C)C(=O)N(C)CCOc1cc(C)cc(C)c1
InChIInChI=1S/C15H24N2O2/c1-11-8-12(2)10-14(9-11)19-7-6-17(5)15(18)13(3)16-4/h8-10,13,16H,6-7H2,1-5H3
InChIKeyHSNZUQUEUSIMQR-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,5-dimethylphenoxy)ethyl]-2,2-difluoro-N-methylacetamide
CID 113219438
N-[2-(4-chlorophenoxy)ethyl]-N-methyl-2-(methylamino)propanamide
CID 60718587
2-acetamido-N-[2-(3,5-dimethylphenoxy)ethyl]-N,3-dimethylbutanamide
CID 18119674
2-(azetidin-3-yl)-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methylpropanamide
CID 116676227
2-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methylacetamide
CID 54869826
(2S,3S)-2-[[2-[2-(3,5-dimethylphenoxy)ethyl-methylamino]-2-oxoethyl]amino]-3-methylpentanoic acid
CID 122100129
methyl 3-[2-(3,5-dimethylphenoxy)ethyl-methylamino]-2-methylpropanoate
CID 60682012
5-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N,4-dimethylpentanamide
CID 82013924
3-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N,2,2-trimethylpropanamide
CID 81489998
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methylimidazole-1-carboxamide
CID 112723531
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2H-triazole-4-carboxamide
CID 112732793
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(propan-2-ylcarbamoylamino)benzamide
CID 55650177

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide?
The IUPAC name of N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide (CID 62639499) is N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide is CNC(C)C(=O)N(C)CCOc1cc(C)cc(C)c1.
What is the InChIKey of N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide?
The InChIKey is HSNZUQUEUSIMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-8-12(2)10-14(9-11)19-7-6-17(5)15(18)13(3)16-4/h8-10,13,16H,6-7H2,1-5H3.
What are the key properties of N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide?
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide has a molecular weight of 264.37 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 62639499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).