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

C8H13F2N — CID 86276612

IUPAC6,6-difluorospiro[2.5]octan-2-amine
SMILESNC1CC12CCC(F)(F)CC2
InChIInChI=1S/C8H13F2N/c9-8(10)3-1-7(2-4-8)5-6(7)11/h6H,1-5,11H2
InChIKeyHZYXMWOXTRIDCI-UHFFFAOYSA-N
MW161.19 g/mol
LogP1.91
Rot. Bonds

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

6,6-difluorospiro[2.5]octan-2-amine (PubChem CID 86276612) has the molecular formula C8H13F2N and a molecular weight of 161.19 g/mol. Its IUPAC name is 6,6-difluorospiro[2.5]octan-2-amine.

Molecular Properties

Compound Name6,6-difluorospiro[2.5]octan-2-amine
PubChem CID86276612
Molecular FormulaC8H13F2N
Molecular Weight161.19 g/mol
Exact Mass161.10
IUPAC Name6,6-difluorospiro[2.5]octan-2-amine
SMILESNC1CC12CCC(F)(F)CC2
InChIInChI=1S/C8H13F2N/c9-8(10)3-1-7(2-4-8)5-6(7)11/h6H,1-5,11H2
InChIKeyHZYXMWOXTRIDCI-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

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Frequently Asked Questions

What is the IUPAC name of 6,6-difluorospiro[2.5]octan-2-amine?
The IUPAC name of 6,6-difluorospiro[2.5]octan-2-amine (CID 86276612) is 6,6-difluorospiro[2.5]octan-2-amine.
What is the SMILES notation for 6,6-difluorospiro[2.5]octan-2-amine?
The canonical SMILES for 6,6-difluorospiro[2.5]octan-2-amine is NC1CC12CCC(F)(F)CC2.
What is the InChIKey of 6,6-difluorospiro[2.5]octan-2-amine?
The InChIKey is HZYXMWOXTRIDCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N/c9-8(10)3-1-7(2-4-8)5-6(7)11/h6H,1-5,11H2.
What are the key properties of 6,6-difluorospiro[2.5]octan-2-amine?
6,6-difluorospiro[2.5]octan-2-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 6,6-difluorospiro[2.5]octan-2-amine is sourced from PubChem (CID 86276612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).