N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine

C8H16FNO — CID 131200870

IUPACN-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine
SMILESCOC1CC(N(C)CCF)C1
InChIInChI=1S/C8H16FNO/c1-10(4-3-9)7-5-8(6-7)11-2/h7-8H,3-6H2,1-2H3
InChIKeyFAELKLIVZUBCTG-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.07
Rot. Bonds4

About N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine

N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine (PubChem CID 131200870) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine
PubChem CID131200870
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC NameN-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine
SMILESCOC1CC(N(C)CCF)C1
InChIInChI=1S/C8H16FNO/c1-10(4-3-9)7-5-8(6-7)11-2/h7-8H,3-6H2,1-2H3
InChIKeyFAELKLIVZUBCTG-UHFFFAOYSA-N
XLogP1.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine?
The IUPAC name of N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine (CID 131200870) is N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine.
What is the SMILES notation for N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine?
The canonical SMILES for N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine is COC1CC(N(C)CCF)C1.
What is the InChIKey of N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine?
The InChIKey is FAELKLIVZUBCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-10(4-3-9)7-5-8(6-7)11-2/h7-8H,3-6H2,1-2H3.
What are the key properties of N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine?
N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine has a molecular weight of 161.22 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-3-methoxy-N-methylcyclobutan-1-amine is sourced from PubChem (CID 131200870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).