3-fluoro-1-methylcyclobutan-1-amine

C5H10FN — CID 76619368

IUPAC3-fluoro-1-methylcyclobutan-1-amine
SMILESCC1(N)CC(F)C1
InChIInChI=1S/C5H10FN/c1-5(7)2-4(6)3-5/h4H,2-3,7H2,1H3
InChIKeyBUZKXSHHVXPYOY-UHFFFAOYSA-N
MW103.14 g/mol
LogP0.84
Rot. Bonds

About 3-fluoro-1-methylcyclobutan-1-amine

3-fluoro-1-methylcyclobutan-1-amine (PubChem CID 76619368) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is 3-fluoro-1-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-fluoro-1-methylcyclobutan-1-amine
PubChem CID76619368
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name3-fluoro-1-methylcyclobutan-1-amine
SMILESCC1(N)CC(F)C1
InChIInChI=1S/C5H10FN/c1-5(7)2-4(6)3-5/h4H,2-3,7H2,1H3
InChIKeyBUZKXSHHVXPYOY-UHFFFAOYSA-N
XLogP0.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1-methylcyclobutan-1-amine?
The IUPAC name of 3-fluoro-1-methylcyclobutan-1-amine (CID 76619368) is 3-fluoro-1-methylcyclobutan-1-amine.
What is the SMILES notation for 3-fluoro-1-methylcyclobutan-1-amine?
The canonical SMILES for 3-fluoro-1-methylcyclobutan-1-amine is CC1(N)CC(F)C1.
What is the InChIKey of 3-fluoro-1-methylcyclobutan-1-amine?
The InChIKey is BUZKXSHHVXPYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN/c1-5(7)2-4(6)3-5/h4H,2-3,7H2,1H3.
What are the key properties of 3-fluoro-1-methylcyclobutan-1-amine?
3-fluoro-1-methylcyclobutan-1-amine has a molecular weight of 103.14 g/mol, XLogP of 0.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-methylcyclobutan-1-amine is sourced from PubChem (CID 76619368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).