1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine

C8H16FNO — CID 80695254

IUPAC1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine
SMILESCNCC1CC(OCCF)C1
InChIInChI=1S/C8H16FNO/c1-10-6-7-4-8(5-7)11-3-2-9/h7-8,10H,2-6H2,1H3
InChIKeyXLJIORGMGIGSOY-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.97
Rot. Bonds5

About 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine

1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine (PubChem CID 80695254) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine
PubChem CID80695254
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine
SMILESCNCC1CC(OCCF)C1
InChIInChI=1S/C8H16FNO/c1-10-6-7-4-8(5-7)11-3-2-9/h7-8,10H,2-6H2,1H3
InChIKeyXLJIORGMGIGSOY-UHFFFAOYSA-N
XLogP0.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Fluoro-4-(propan-2-yloxymethyl)piperidine
CID 122547224
N-methyl-4-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62445978
N-(2-methylpropyl)-4-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62446355
1-[3-(2,2-difluoroethoxy)cyclobutyl]-N-methylmethanamine
CID 65987788
N-methyl-1-[3-[2-(2,2,2-trifluoroethoxy)ethoxy]cyclobutyl]methanamine
CID 65988428
N-methyl-1-[3-(2,2,2-trifluoroethoxy)cyclobutyl]methanamine
CID 65989450
N-methyl-1-[3-[3-(2,2,2-trifluoroethoxy)propoxy]cyclobutyl]methanamine
CID 65989661
N-methyl-1-[3-[2-(trifluoromethoxy)ethoxy]cyclobutyl]methanamine
CID 65989873
N-methyl-1-[3-(3,3,3-trifluoropropoxy)cyclobutyl]methanamine
CID 65990467
N-(2-methylpropyl)-4-(1,1,1-trifluoropropan-2-yloxy)pentan-1-amine
CID 66274666
N-methyl-4-(1,1,1-trifluoropropan-2-yloxy)pentan-1-amine
CID 66275971
[3-(3-Fluoropropoxy)cyclobutyl]methanamine
CID 81113511

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine (CID 80695254) is 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine is CNCC1CC(OCCF)C1.
What is the InChIKey of 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine?
The InChIKey is XLJIORGMGIGSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-10-6-7-4-8(5-7)11-3-2-9/h7-8,10H,2-6H2,1H3.
What are the key properties of 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine?
1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine has a molecular weight of 161.22 g/mol, XLogP of 0.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-fluoroethoxy)cyclobutyl]-N-methylmethanamine is sourced from PubChem (CID 80695254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).