2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine

C13H18FNO — CID 103273573

IUPAC2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine
SMILESCNCCC1(Oc2ccccc2F)CCC1
InChIInChI=1S/C13H18FNO/c1-15-10-9-13(7-4-8-13)16-12-6-3-2-5-11(12)14/h2-3,5-6,15H,4,7-10H2,1H3
InChIKeyUIEFQZHMCJWLAY-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.74
Rot. Bonds5

About 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine

2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine (PubChem CID 103273573) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine.

Molecular Properties

Compound Name2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine
PubChem CID103273573
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine
SMILESCNCCC1(Oc2ccccc2F)CCC1
InChIInChI=1S/C13H18FNO/c1-15-10-9-13(7-4-8-13)16-12-6-3-2-5-11(12)14/h2-3,5-6,15H,4,7-10H2,1H3
InChIKeyUIEFQZHMCJWLAY-UHFFFAOYSA-N
XLogP2.74
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-ethylphenoxy)cyclobutyl]-N-methylethanamine
CID 103273871
2-[1-(5-bromo-2-fluorophenoxy)cyclobutyl]-N-methylethanamine
CID 103274512
N-[2-[1-(2-methylsulfanylphenoxy)cyclobutyl]ethyl]propan-2-amine
CID 103274063
2-[1-(2,5-dimethylphenoxy)cyclobutyl]-N-methylethanamine
CID 103273603
N-methyl-2-[1-(4-methylsulfanylphenoxy)cyclobutyl]ethanamine
CID 103274071
2-[1-(2-bromo-4-methylphenoxy)cyclobutyl]-N-methylethanamine
CID 103273796
2-[1-(3,4-dimethylphenoxy)cyclobutyl]-N-methylethanamine
CID 103273611
2-[1-(2-bromophenoxy)cyclobutyl]-N-ethylethanamine
CID 103273382
5-(2-fluorophenoxy)-N-methylpentan-1-amine
CID 62453005
N-[2-[1-(2-tert-butylphenoxy)cyclobutyl]ethyl]propan-1-amine
CID 103273476
N-methyl-2-[1-[(1-methyl-1,2,4-triazol-3-yl)oxy]cyclobutyl]ethanamine
CID 106598111
N-[2-[1-(4-fluoro-2-methylphenoxy)cyclobutyl]ethyl]propan-2-amine
CID 103274345

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine?
The IUPAC name of 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine (CID 103273573) is 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine.
What is the SMILES notation for 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine?
The canonical SMILES for 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine is CNCCC1(Oc2ccccc2F)CCC1.
What is the InChIKey of 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine?
The InChIKey is UIEFQZHMCJWLAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-15-10-9-13(7-4-8-13)16-12-6-3-2-5-11(12)14/h2-3,5-6,15H,4,7-10H2,1H3.
What are the key properties of 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine?
2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine has a molecular weight of 223.29 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-fluorophenoxy)cyclobutyl]-N-methylethanamine is sourced from PubChem (CID 103273573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).