2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride

C9H14ClF2N — CID 146155558

IUPAC2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride
SMILESCl.FC1(F)CC2(C1)CC1(CNC1)C2
InChIInChI=1S/C9H13F2N.ClH/c10-9(11)3-7(4-9)1-8(2-7)5-12-6-8;/h12H,1-6H2;1H
InChIKeyOGJBAEGYUJZCCH-UHFFFAOYSA-N
MW209.67 g/mol
LogP2.21
Rot. Bonds

About 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride

2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride (PubChem CID 146155558) has the molecular formula C9H14ClF2N and a molecular weight of 209.67 g/mol. Its IUPAC name is 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride.

Molecular Properties

Compound Name2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride
PubChem CID146155558
Molecular FormulaC9H14ClF2N
Molecular Weight209.67 g/mol
Exact Mass209.08
IUPAC Name2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride
SMILESCl.FC1(F)CC2(C1)CC1(CNC1)C2
InChIInChI=1S/C9H13F2N.ClH/c10-9(11)3-7(4-9)1-8(2-7)5-12-6-8;/h12H,1-6H2;1H
InChIKeyOGJBAEGYUJZCCH-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.67
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride?
The IUPAC name of 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride (CID 146155558) is 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride.
What is the SMILES notation for 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride?
The canonical SMILES for 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride is Cl.FC1(F)CC2(C1)CC1(CNC1)C2.
What is the InChIKey of 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride?
The InChIKey is OGJBAEGYUJZCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F2N.ClH/c10-9(11)3-7(4-9)1-8(2-7)5-12-6-8;/h12H,1-6H2;1H.
What are the key properties of 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride?
2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride has a molecular weight of 209.67 g/mol, XLogP of 2.21, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-8-azadispiro[3.1.36.14]decane;hydrochloride is sourced from PubChem (CID 146155558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).