2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide

C14H19FN2O2 — CID 54872660

IUPAC2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
SMILESCN(CCOc1cccc(F)c1)C(=O)CNC1CC1
InChIInChI=1S/C14H19FN2O2/c1-17(14(18)10-16-12-5-6-12)7-8-19-13-4-2-3-11(15)9-13/h2-4,9,12,16H,5-8,10H2,1H3
InChIKeyQTZGOHZOIOZHDE-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.41
Rot. Bonds7

About 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide

2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide (PubChem CID 54872660) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
PubChem CID54872660
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
SMILESCN(CCOc1cccc(F)c1)C(=O)CNC1CC1
InChIInChI=1S/C14H19FN2O2/c1-17(14(18)10-16-12-5-6-12)7-8-19-13-4-2-3-11(15)9-13/h2-4,9,12,16H,5-8,10H2,1H3
InChIKeyQTZGOHZOIOZHDE-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-methyl-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 54872517
4-chloro-N-[2-(3-fluorophenoxy)ethyl]-N-methylbutanamide
CID 63307611
3-[3-(3-fluorophenoxy)propanoyl-methylamino]propanoic acid
CID 60989974
N-[2-(3-fluorophenoxy)ethyl]cyclopropanamine
CID 29015732
2-(1-aminocyclopentyl)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
CID 64679568
3-fluoro-N-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]benzamide
CID 78783855
2-[2-(3-fluorophenoxy)ethyl-methylamino]propanamide
CID 47286834
2-(ethylamino)-N-[2-(3-fluorophenoxy)ethyl]-N,2-dimethylpropanamide
CID 62836449
N-[2-(3-fluorophenoxy)ethyl]-N-methyl-2-[(3R)-thiomorpholin-3-yl]acetamide
CID 97109015
N-[3-(3-fluorophenoxy)propyl]cyclopentanamine
CID 62571696
3-(3-fluorophenoxy)-N-(2-hydroxycyclohexyl)-N-methylpropanamide
CID 102634743
N-[2-(3-fluorophenoxy)ethyl]-N-methylfuran-2-carboxamide
CID 61063132

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide (CID 54872660) is 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide is CN(CCOc1cccc(F)c1)C(=O)CNC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide?
The InChIKey is QTZGOHZOIOZHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-17(14(18)10-16-12-5-6-12)7-8-19-13-4-2-3-11(15)9-13/h2-4,9,12,16H,5-8,10H2,1H3.
What are the key properties of 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide?
2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide has a molecular weight of 266.32 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide is sourced from PubChem (CID 54872660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).