1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone

C13H19NO2 — CID 61446564

IUPAC1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone
SMILESCCN(CCOC)c1ccc(C(C)=O)cc1
InChIInChI=1S/C13H19NO2/c1-4-14(9-10-16-3)13-7-5-12(6-8-13)11(2)15/h5-8H,4,9-10H2,1-3H3
InChIKeyFOXDRFBTKPIKMR-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.36
Rot. Bonds6

About 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone

1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone (PubChem CID 61446564) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone
PubChem CID61446564
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone
SMILESCCN(CCOC)c1ccc(C(C)=O)cc1
InChIInChI=1S/C13H19NO2/c1-4-14(9-10-16-3)13-7-5-12(6-8-13)11(2)15/h5-8H,4,9-10H2,1-3H3
InChIKeyFOXDRFBTKPIKMR-UHFFFAOYSA-N
XLogP2.36
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[2-(dimethylamino)ethyl-ethylamino]phenyl]ethanone
CID 123268766
2,4-bis[4-[ethyl(2-methoxyethyl)amino]phenyl]pentan-3-one
CID 174404931
1-[3-bromo-4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone
CID 62908123
1-[4-[2-methoxyethyl(propan-2-yl)amino]phenyl]ethanone
CID 82951599
N-(4-acetylphenyl)-N'-[4-(diethylamino)phenyl]oxamide
CID 108514837
N-ethyl-N-(2-methoxyethyl)-4-(4-methoxyphenoxy)aniline
CID 134547003
5-[ethyl(2-methoxyethyl)amino]pyridine-2-carboxylic acid
CID 115490842
[4-[bis(2-methoxyethyl)amino]phenyl] acetate;ethane
CID 91153786
4-(diethylamino)-N-(3-methoxypropyl)benzamide
CID 17310827
N-(4-acetylphenyl)-3-(N-ethyl-4-fluoroanilino)propanamide
CID 56525325
2-[(4-acetylbenzoyl)-(2-methoxyethyl)amino]acetic acid
CID 119188945
4-amino-3-[ethyl(2-methoxyethyl)amino]benzamide
CID 55190704

Frequently Asked Questions

What is the IUPAC name of 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone?
The IUPAC name of 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone (CID 61446564) is 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone.
What is the SMILES notation for 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone?
The canonical SMILES for 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone is CCN(CCOC)c1ccc(C(C)=O)cc1.
What is the InChIKey of 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone?
The InChIKey is FOXDRFBTKPIKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-4-14(9-10-16-3)13-7-5-12(6-8-13)11(2)15/h5-8H,4,9-10H2,1-3H3.
What are the key properties of 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone?
1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone has a molecular weight of 221.30 g/mol, XLogP of 2.36, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone is sourced from PubChem (CID 61446564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).