2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide

C13H19FN2O2 — CID 55140277

IUPAC2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide
SMILESCC(c1ccccc1F)N(C)CC(=O)NCCO
InChIInChI=1S/C13H19FN2O2/c1-10(11-5-3-4-6-12(11)14)16(2)9-13(18)15-7-8-17/h3-6,10,17H,7-9H2,1-2H3,(H,15,18)
InChIKeyAQGFYJULLOPDNJ-UHFFFAOYSA-N
MW254.30 g/mol
LogP0.93
Rot. Bonds6

About 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide

2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide (PubChem CID 55140277) has the molecular formula C13H19FN2O2 and a molecular weight of 254.30 g/mol. Its IUPAC name is 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide
PubChem CID55140277
Molecular FormulaC13H19FN2O2
Molecular Weight254.30 g/mol
Exact Mass254.14
IUPAC Name2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide
SMILESCC(c1ccccc1F)N(C)CC(=O)NCCO
InChIInChI=1S/C13H19FN2O2/c1-10(11-5-3-4-6-12(11)14)16(2)9-13(18)15-7-8-17/h3-6,10,17H,7-9H2,1-2H3,(H,15,18)
InChIKeyAQGFYJULLOPDNJ-UHFFFAOYSA-N
XLogP0.93
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-fluorophenyl)ethyl-methylamino]acetic acid
CID 62979540
2-[1-(2,5-difluorophenyl)ethyl-methylamino]-N-propylacetamide
CID 60503075
2-[1-(2-fluoro-4-hydroxyphenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 107721043
2-[1-(2-chlorophenyl)ethyl-methylamino]-N-ethylacetamide
CID 60505315
3-(ethylamino)-4-[1-(2-fluorophenyl)ethyl-methylamino]butan-1-ol
CID 64898179
2-[1-(2-fluorophenyl)ethyl-methylamino]-N'-hydroxyethanimidamide
CID 76979744
2-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylethanone
CID 61018397
1-(3-bromophenyl)-2-[1-(2-fluorophenyl)ethyl-methylamino]ethanone
CID 62978155
1-[1-(2-fluorophenyl)ethyl-methylamino]-2-methylpropan-2-ol
CID 62980625
2-(dimethylamino)-2-(2-fluorophenyl)-N-(3-hydroxypropyl)acetamide
CID 72891697
2-amino-N-[2-[1-(2-fluorophenyl)ethyl-methylamino]-2-oxoethyl]acetamide
CID 54870514
N-[1-(2-fluorophenyl)ethyl]-N-methyl-2-(methylamino)acetamide
CID 60939648

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide (CID 55140277) is 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide is CC(c1ccccc1F)N(C)CC(=O)NCCO.
What is the InChIKey of 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide?
The InChIKey is AQGFYJULLOPDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O2/c1-10(11-5-3-4-6-12(11)14)16(2)9-13(18)15-7-8-17/h3-6,10,17H,7-9H2,1-2H3,(H,15,18).
What are the key properties of 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide?
2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide has a molecular weight of 254.30 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-fluorophenyl)ethyl-methylamino]-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 55140277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).