2,2-difluorospiro[2.5]octan-6-amine

C8H13F2N — CID 105431582

IUPAC2,2-difluorospiro[2.5]octan-6-amine
SMILESNC1CCC2(CC1)CC2(F)F
InChIInChI=1S/C8H13F2N/c9-8(10)5-7(8)3-1-6(11)2-4-7/h6H,1-5,11H2
InChIKeyBSCLVOMPNSVOPF-UHFFFAOYSA-N
MW161.19 g/mol
LogP1.91
Rot. Bonds

About 2,2-difluorospiro[2.5]octan-6-amine

2,2-difluorospiro[2.5]octan-6-amine (PubChem CID 105431582) has the molecular formula C8H13F2N and a molecular weight of 161.19 g/mol. Its IUPAC name is 2,2-difluorospiro[2.5]octan-6-amine.

Molecular Properties

Compound Name2,2-difluorospiro[2.5]octan-6-amine
PubChem CID105431582
Molecular FormulaC8H13F2N
Molecular Weight161.19 g/mol
Exact Mass161.10
IUPAC Name2,2-difluorospiro[2.5]octan-6-amine
SMILESNC1CCC2(CC1)CC2(F)F
InChIInChI=1S/C8H13F2N/c9-8(10)5-7(8)3-1-6(11)2-4-7/h6H,1-5,11H2
InChIKeyBSCLVOMPNSVOPF-UHFFFAOYSA-N
XLogP1.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.19
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,2-difluorospiro[2.5]octan-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-difluorospiro[2.5]octan-6-amine?
The IUPAC name of 2,2-difluorospiro[2.5]octan-6-amine (CID 105431582) is 2,2-difluorospiro[2.5]octan-6-amine.
What is the SMILES notation for 2,2-difluorospiro[2.5]octan-6-amine?
The canonical SMILES for 2,2-difluorospiro[2.5]octan-6-amine is NC1CCC2(CC1)CC2(F)F.
What is the InChIKey of 2,2-difluorospiro[2.5]octan-6-amine?
The InChIKey is BSCLVOMPNSVOPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N/c9-8(10)5-7(8)3-1-6(11)2-4-7/h6H,1-5,11H2.
What are the key properties of 2,2-difluorospiro[2.5]octan-6-amine?
2,2-difluorospiro[2.5]octan-6-amine has a molecular weight of 161.19 g/mol, XLogP of 1.91, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluorospiro[2.5]octan-6-amine is sourced from PubChem (CID 105431582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).