6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride

C6H10ClF2N — CID 126845039

IUPAC6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride
SMILESCl.NC1CCC2C1C2(F)F
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)3-1-2-4(9)5(3)6;/h3-5H,1-2,9H2;1H
InChIKeyZREPCCQVORWBOK-UHFFFAOYSA-N
MW169.60 g/mol
LogP1.41
Rot. Bonds

About 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride

6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride (PubChem CID 126845039) has the molecular formula C6H10ClF2N and a molecular weight of 169.60 g/mol. Its IUPAC name is 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride.

Molecular Properties

Compound Name6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride
PubChem CID126845039
Molecular FormulaC6H10ClF2N
Molecular Weight169.60 g/mol
Exact Mass169.05
IUPAC Name6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride
SMILESCl.NC1CCC2C1C2(F)F
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)3-1-2-4(9)5(3)6;/h3-5H,1-2,9H2;1H
InChIKeyZREPCCQVORWBOK-UHFFFAOYSA-N
XLogP1.41
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 ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride?
The IUPAC name of 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride (CID 126845039) is 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride.
What is the SMILES notation for 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride?
The canonical SMILES for 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride is Cl.NC1CCC2C1C2(F)F.
What is the InChIKey of 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride?
The InChIKey is ZREPCCQVORWBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2N.ClH/c7-6(8)3-1-2-4(9)5(3)6;/h3-5H,1-2,9H2;1H.
What are the key properties of 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride?
6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride has a molecular weight of 169.60 g/mol, XLogP of 1.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluorobicyclo[3.1.0]hexan-2-amine;hydrochloride is sourced from PubChem (CID 126845039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).