2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine

C14H20FNO — CID 116714161

IUPAC2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
SMILESCNC(Cc1ccccc1F)C1(OC)CCC1
InChIInChI=1S/C14H20FNO/c1-16-13(14(17-2)8-5-9-14)10-11-6-3-4-7-12(11)15/h3-4,6-7,13,16H,5,8-10H2,1-2H3
InChIKeyXBNAPXPJQXWLCW-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.53
Rot. Bonds5

About 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine

2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine (PubChem CID 116714161) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
PubChem CID116714161
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
SMILESCNC(Cc1ccccc1F)C1(OC)CCC1
InChIInChI=1S/C14H20FNO/c1-16-13(14(17-2)8-5-9-14)10-11-6-3-4-7-12(11)15/h3-4,6-7,13,16H,5,8-10H2,1-2H3
InChIKeyXBNAPXPJQXWLCW-UHFFFAOYSA-N
XLogP2.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-fluorophenyl)-1-(1-methoxycyclohexyl)ethyl]hydrazine
CID 105276009
2-(2-bromophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
CID 116714359
2-(2-bromo-3-fluorophenyl)-1-(1-methoxycyclohexyl)-N-methylethanamine
CID 116762886
1-(1-methoxycyclohexyl)-N-methyl-2-(2-methylphenyl)ethanamine
CID 116762893
2-(5-fluoro-2-methylphenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
CID 105374348
1-(1-ethoxy-4-methylcyclohexyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 116767103
[2-(2-chloro-3-fluorophenyl)-1-(1-methoxycyclobutyl)ethyl]hydrazine
CID 105270220
[1-(1-ethoxycyclopentyl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105275708
N-ethyl-2-(2-fluorophenyl)-1-(1-methoxy-4-methylcyclohexyl)ethanamine
CID 116766591
2-(2-chloro-3-fluorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
CID 116714589
2-(3-bromo-2,6-difluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
CID 106268475
2-(2-bromo-4-fluorophenyl)-1-(1-methoxycyclohexyl)-N-methylethanamine
CID 116762866

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine?
The IUPAC name of 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine (CID 116714161) is 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine is CNC(Cc1ccccc1F)C1(OC)CCC1.
What is the InChIKey of 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine?
The InChIKey is XBNAPXPJQXWLCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-16-13(14(17-2)8-5-9-14)10-11-6-3-4-7-12(11)15/h3-4,6-7,13,16H,5,8-10H2,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine?
2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine has a molecular weight of 237.32 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine is sourced from PubChem (CID 116714161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).