2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one

C15H22FNO2 — CID 55010167

IUPAC2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one
SMILESCCN(C(C)COC)C(C)C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H22FNO2/c1-5-17(11(2)10-19-4)12(3)15(18)13-6-8-14(16)9-7-13/h6-9,11-12H,5,10H2,1-4H3
InChIKeyFUSSABHFWLGAEW-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.75
Rot. Bonds7

About 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one

2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one (PubChem CID 55010167) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one.

Molecular Properties

Compound Name2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one
PubChem CID55010167
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one
SMILESCCN(C(C)COC)C(C)C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H22FNO2/c1-5-17(11(2)10-19-4)12(3)15(18)13-6-8-14(16)9-7-13/h6-9,11-12H,5,10H2,1-4H3
InChIKeyFUSSABHFWLGAEW-UHFFFAOYSA-N
XLogP2.75
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-methylphenyl)propan-1-one
CID 55010842
2-[ethyl(methyl)amino]-1-(4-fluorophenyl)propan-1-one
CID 43794816
4-fluoro-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)benzamide
CID 54978956
2-amino-1-(4-fluorophenyl)-3-methoxypropan-1-one
CID 116594008
1-(4-bromophenyl)-2-[1-methoxypropan-2-yl(methyl)amino]propan-1-one
CID 54946475
1-(4-fluorophenyl)-2-(2-methylpropoxy)propan-1-one
CID 43798747
1-(4-fluorophenyl)-2-(3-methoxypropoxy)propan-1-one
CID 54936830
2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
CID 82952096
3-[ethyl(1-methoxypropan-2-yl)amino]-2,2-dimethyl-1-phenylpropan-1-one
CID 63193751
2-bromo-N-[(4-fluorophenyl)methyl]-N-[(2S)-1-methoxypropan-2-yl]acetamide
CID 118957425
2-fluoro-N-(1-methoxypropan-2-yl)-N-methylbenzamide
CID 60794014
4-carbamothioyl-N-(1-methoxypropan-2-yl)-N-methylbenzamide
CID 54946736

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one?
The IUPAC name of 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one (CID 55010167) is 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one.
What is the SMILES notation for 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one?
The canonical SMILES for 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one is CCN(C(C)COC)C(C)C(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one?
The InChIKey is FUSSABHFWLGAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-5-17(11(2)10-19-4)12(3)15(18)13-6-8-14(16)9-7-13/h6-9,11-12H,5,10H2,1-4H3.
What are the key properties of 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one?
2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one has a molecular weight of 267.34 g/mol, XLogP of 2.75, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(1-methoxypropan-2-yl)amino]-1-(4-fluorophenyl)propan-1-one is sourced from PubChem (CID 55010167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).