1-cyclobutyl-3-fluorobutan-2-amine

C8H16FN — CID 84649039

IUPAC1-cyclobutyl-3-fluorobutan-2-amine
SMILESCC(F)C(N)CC1CCC1
InChIInChI=1S/C8H16FN/c1-6(9)8(10)5-7-3-2-4-7/h6-8H,2-5,10H2,1H3
InChIKeyPRNXCEHZFTVIFX-UHFFFAOYSA-N
MW145.22 g/mol
LogP1.86
Rot. Bonds3

About 1-cyclobutyl-3-fluorobutan-2-amine

1-cyclobutyl-3-fluorobutan-2-amine (PubChem CID 84649039) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 1-cyclobutyl-3-fluorobutan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-3-fluorobutan-2-amine
PubChem CID84649039
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name1-cyclobutyl-3-fluorobutan-2-amine
SMILESCC(F)C(N)CC1CCC1
InChIInChI=1S/C8H16FN/c1-6(9)8(10)5-7-3-2-4-7/h6-8H,2-5,10H2,1H3
InChIKeyPRNXCEHZFTVIFX-UHFFFAOYSA-N
XLogP1.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1,2-di(cyclobutyl)ethanamine
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2-cyclopropylpropylcyclobutane
CID 54087952
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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-fluorobutan-2-amine?
The IUPAC name of 1-cyclobutyl-3-fluorobutan-2-amine (CID 84649039) is 1-cyclobutyl-3-fluorobutan-2-amine.
What is the SMILES notation for 1-cyclobutyl-3-fluorobutan-2-amine?
The canonical SMILES for 1-cyclobutyl-3-fluorobutan-2-amine is CC(F)C(N)CC1CCC1.
What is the InChIKey of 1-cyclobutyl-3-fluorobutan-2-amine?
The InChIKey is PRNXCEHZFTVIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-6(9)8(10)5-7-3-2-4-7/h6-8H,2-5,10H2,1H3.
What are the key properties of 1-cyclobutyl-3-fluorobutan-2-amine?
1-cyclobutyl-3-fluorobutan-2-amine has a molecular weight of 145.22 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-fluorobutan-2-amine is sourced from PubChem (CID 84649039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).