2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride

C6H10ClF2N — CID 122164180

IUPAC2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride
SMILESCl.NC1CC2(C1)CC2(F)F
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)3-5(6)1-4(9)2-5;/h4H,1-3,9H2;1H
InChIKeyWGDAQAXOMRICLG-UHFFFAOYSA-N
MW169.60 g/mol
LogP1.55
Rot. Bonds

About 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride

2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride (PubChem CID 122164180) has the molecular formula C6H10ClF2N and a molecular weight of 169.60 g/mol. Its IUPAC name is 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride.

Molecular Properties

Compound Name2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride
PubChem CID122164180
Molecular FormulaC6H10ClF2N
Molecular Weight169.60 g/mol
Exact Mass169.05
IUPAC Name2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride
SMILESCl.NC1CC2(C1)CC2(F)F
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)3-5(6)1-4(9)2-5;/h4H,1-3,9H2;1H
InChIKeyWGDAQAXOMRICLG-UHFFFAOYSA-N
XLogP1.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.60
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride 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[2.3]hexan-5-amine;hydrochloride?
The IUPAC name of 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride (CID 122164180) is 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride.
What is the SMILES notation for 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride?
The canonical SMILES for 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride is Cl.NC1CC2(C1)CC2(F)F.
What is the InChIKey of 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride?
The InChIKey is WGDAQAXOMRICLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2N.ClH/c7-6(8)3-5(6)1-4(9)2-5;/h4H,1-3,9H2;1H.
What are the key properties of 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride?
2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride has a molecular weight of 169.60 g/mol, XLogP of 1.55, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluorospiro[2.3]hexan-5-amine;hydrochloride is sourced from PubChem (CID 122164180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).