2-(2,6-difluorophenyl)cyclobutan-1-amine

C10H11F2N — CID 81014368

IUPAC2-(2,6-difluorophenyl)cyclobutan-1-amine
SMILESNC1CCC1c1c(F)cccc1F
InChIInChI=1S/C10H11F2N/c11-7-2-1-3-8(12)10(7)6-4-5-9(6)13/h1-3,6,9H,4-5,13H2
InChIKeyGDMNAHPHGGHIRV-UHFFFAOYSA-N
MW183.20 g/mol
LogP2.17
Rot. Bonds1

About 2-(2,6-difluorophenyl)cyclobutan-1-amine

2-(2,6-difluorophenyl)cyclobutan-1-amine (PubChem CID 81014368) has the molecular formula C10H11F2N and a molecular weight of 183.20 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)cyclobutan-1-amine.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)cyclobutan-1-amine
PubChem CID81014368
Molecular FormulaC10H11F2N
Molecular Weight183.20 g/mol
Exact Mass183.09
IUPAC Name2-(2,6-difluorophenyl)cyclobutan-1-amine
SMILESNC1CCC1c1c(F)cccc1F
InChIInChI=1S/C10H11F2N/c11-7-2-1-3-8(12)10(7)6-4-5-9(6)13/h1-3,6,9H,4-5,13H2
InChIKeyGDMNAHPHGGHIRV-UHFFFAOYSA-N
XLogP2.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.20
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)cyclobutan-1-amine?
The IUPAC name of 2-(2,6-difluorophenyl)cyclobutan-1-amine (CID 81014368) is 2-(2,6-difluorophenyl)cyclobutan-1-amine.
What is the SMILES notation for 2-(2,6-difluorophenyl)cyclobutan-1-amine?
The canonical SMILES for 2-(2,6-difluorophenyl)cyclobutan-1-amine is NC1CCC1c1c(F)cccc1F.
What is the InChIKey of 2-(2,6-difluorophenyl)cyclobutan-1-amine?
The InChIKey is GDMNAHPHGGHIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2N/c11-7-2-1-3-8(12)10(7)6-4-5-9(6)13/h1-3,6,9H,4-5,13H2.
What are the key properties of 2-(2,6-difluorophenyl)cyclobutan-1-amine?
2-(2,6-difluorophenyl)cyclobutan-1-amine has a molecular weight of 183.20 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)cyclobutan-1-amine is sourced from PubChem (CID 81014368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).