2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone

C16H25NO2 — CID 61446805

IUPAC2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
SMILESCCN(CCOC)CC(=O)c1cc(C)c(C)cc1C
InChIInChI=1S/C16H25NO2/c1-6-17(7-8-19-5)11-16(18)15-10-13(3)12(2)9-14(15)4/h9-10H,6-8,11H2,1-5H3
InChIKeyGQGSUCQLRBZFNG-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.76
Rot. Bonds7

About 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone

2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone (PubChem CID 61446805) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone.

Molecular Properties

Compound Name2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
PubChem CID61446805
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
SMILESCCN(CCOC)CC(=O)c1cc(C)c(C)cc1C
InChIInChI=1S/C16H25NO2/c1-6-17(7-8-19-5)11-16(18)15-10-13(3)12(2)9-14(15)4/h9-10H,6-8,11H2,1-5H3
InChIKeyGQGSUCQLRBZFNG-UHFFFAOYSA-N
XLogP2.76
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dipropylamino)-1-(2,4,5-trimethylphenyl)ethanone
CID 43219591
1-(2,5-dichlorothiophen-3-yl)-2-[ethyl(2-methoxyethyl)amino]ethanone
CID 54948907
2-[ethyl(2-methylpropyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
CID 43795911
1-(3,4-difluorophenyl)-2-[ethyl(2-methoxyethyl)amino]ethanone
CID 54948866
2-[2-hydroxyethyl(propyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
CID 62051328
2-[bis(2-methylpropyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
CID 60649688
2-(diethylamino)-1-(2-ethoxy-4,5-dimethylphenyl)ethanone
CID 82053889
2-[ethyl(2-methoxyethyl)amino]-1-(3-methoxyphenyl)ethanone
CID 61446317
2-[ethyl(2-methoxyethyl)amino]-1-(3-fluorophenyl)ethanone
CID 54949360
2-[[ethyl(2-methoxyethyl)amino]methyl]-4-fluorobenzoic acid
CID 107907739
ethane;ethyl 2-[ethyl(2-methoxyethyl)amino]acetate
CID 156838372
2-[ethyl(thiophen-2-ylmethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone
CID 62036551

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone?
The IUPAC name of 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone (CID 61446805) is 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone.
What is the SMILES notation for 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone?
The canonical SMILES for 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone is CCN(CCOC)CC(=O)c1cc(C)c(C)cc1C.
What is the InChIKey of 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone?
The InChIKey is GQGSUCQLRBZFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-6-17(7-8-19-5)11-16(18)15-10-13(3)12(2)9-14(15)4/h9-10H,6-8,11H2,1-5H3.
What are the key properties of 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone?
2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone has a molecular weight of 263.38 g/mol, XLogP of 2.76, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-methoxyethyl)amino]-1-(2,4,5-trimethylphenyl)ethanone is sourced from PubChem (CID 61446805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).