1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one

C14H21NO2 — CID 54949080

IUPAC1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one
SMILESCCN(CCOC)CC(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2/c1-3-15(9-10-17-2)12-14(16)11-13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3
InChIKeyLGLUCIFFCHAHJU-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.77
Rot. Bonds8

About 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one

1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one (PubChem CID 54949080) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one.

Molecular Properties

Compound Name1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one
PubChem CID54949080
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one
SMILESCCN(CCOC)CC(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2/c1-3-15(9-10-17-2)12-14(16)11-13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3
InChIKeyLGLUCIFFCHAHJU-UHFFFAOYSA-N
XLogP1.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-methoxypropan-2-yl(methyl)amino]-3-phenylpropan-2-one
CID 54946725
N-ethyl-2-[ethyl-(2-oxo-3-phenylpropyl)amino]acetamide
CID 62030498
1,3-diphenylpropan-2-one;ethane;methoxymethylbenzene
CID 167578330
1,3-diphenylpropan-2-one;ethane;methoxymethylbenzene
CID 159058422
3-[[ethyl(2-methoxyethyl)amino]methyl]benzoic acid
CID 55136245
1-[ethyl(furan-2-ylmethyl)amino]-3-phenylpropan-2-one
CID 62037011
2-[bis(2-methoxyethyl)amino]-1-phenylethanone
CID 60649797
N,N-bis(2-methoxyethyl)-2-phenylethanamine
CID 16753331
benzyl 3-[2-[ethyl(2-methoxyethyl)amino]ethylamino]propanoate
CID 57301995
2-[benzyl(4-methoxybutyl)amino]acetic acid
CID 119134936
2-[ethyl(2-methoxyethyl)amino]-N,N-dimethylacetamide
CID 135183389
2-[ethyl(2-methoxyethyl)amino]-1-(3-fluorophenyl)ethanone
CID 54949360

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one?
The IUPAC name of 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one (CID 54949080) is 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one.
What is the SMILES notation for 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one?
The canonical SMILES for 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one is CCN(CCOC)CC(=O)Cc1ccccc1.
What is the InChIKey of 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one?
The InChIKey is LGLUCIFFCHAHJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-15(9-10-17-2)12-14(16)11-13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3.
What are the key properties of 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one?
1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one has a molecular weight of 235.33 g/mol, XLogP of 1.77, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(2-methoxyethyl)amino]-3-phenylpropan-2-one is sourced from PubChem (CID 54949080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).