8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride

C8H14ClF2N — CID 105451192

IUPAC8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride
SMILESCl.FC1(F)CCC2(CCNC2)C1
InChIInChI=1S/C8H13F2N.ClH/c9-8(10)2-1-7(5-8)3-4-11-6-7;/h11H,1-6H2;1H
InChIKeyYUOVRHOZEUMURF-UHFFFAOYSA-N
MW197.66 g/mol
LogP2.21
Rot. Bonds

About 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride

8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride (PubChem CID 105451192) has the molecular formula C8H14ClF2N and a molecular weight of 197.66 g/mol. Its IUPAC name is 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride.

Molecular Properties

Compound Name8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride
PubChem CID105451192
Molecular FormulaC8H14ClF2N
Molecular Weight197.66 g/mol
Exact Mass197.08
IUPAC Name8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride
SMILESCl.FC1(F)CCC2(CCNC2)C1
InChIInChI=1S/C8H13F2N.ClH/c9-8(10)2-1-7(5-8)3-4-11-6-7;/h11H,1-6H2;1H
InChIKeyYUOVRHOZEUMURF-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.66
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Azaspiro(4.4)nonane
CID 418904
4,4-Difluoro-2-azaspiro(4.4)nonane hydrochloride
CID 105451193
2,2-Difluoro-8-azaspiro[4.5]decane
CID 115014468
2,2-Difluoro-8-azaspiro(4.5)decane hydrochloride
CID 138987742
2,2-Difluoro-6-azaspiro(3.4)octane;hydrochloride
CID 146082221
6,6-Difluoro-2-azaspiro[4.4]nonane hydrochloride
CID 105451191
4-(Fluoromethyl)-2-azaspiro[4.4]nonane
CID 121199384
rac-(3aR,6aR)-3a-(trifluoromethyl)-octahydrocyclopenta(c)pyrrole hydrochloride
CID 126836660
7-(Trifluoromethyl)-6-azaspiro[3.4]octane hydrochloride
CID 137990914
8-(Trifluoromethyl)-6-azaspiro(3.4)octane hydrochloride
CID 165767739
(7S)-2,2-difluoro-7-methyl-6-azaspiro(3.4)octane hydrochloride
CID 165885107
(7R)-2,2-difluoro-7-methyl-6-azaspiro[3.4]octane hydrochloride
CID 167736101

Frequently Asked Questions

What is the IUPAC name of 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride?
The IUPAC name of 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride (CID 105451192) is 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride.
What is the SMILES notation for 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride?
The canonical SMILES for 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride is Cl.FC1(F)CCC2(CCNC2)C1.
What is the InChIKey of 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride?
The InChIKey is YUOVRHOZEUMURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N.ClH/c9-8(10)2-1-7(5-8)3-4-11-6-7;/h11H,1-6H2;1H.
What are the key properties of 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride?
8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride has a molecular weight of 197.66 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 8,8-difluoro-2-azaspiro[4.4]nonane;hydrochloride is sourced from PubChem (CID 105451192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).