lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride

C6H16AlClF3LiN2 — CID 173354078

IUPAClithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride
SMILESCl.NN1CCC(C(F)(F)F)CC1.[AlH3].[H-].[Li+]
InChIInChI=1S/C6H11F3N2.Al.ClH.Li.4H/c7-6(8,9)5-1-3-11(10)4-2-5;;;;;;;/h5H,1-4,10H2;;1H;;;;;/q;;;+1;;;;-1
InChIKeyZIHUEIXMACNFTO-UHFFFAOYSA-N
MW242.58 g/mol
LogP-2.51
Rot. Bonds

About lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride

lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride (PubChem CID 173354078) has the molecular formula C6H16AlClF3LiN2 and a molecular weight of 242.58 g/mol. Its IUPAC name is lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride.

Molecular Properties

Compound Namelithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride
PubChem CID173354078
Molecular FormulaC6H16AlClF3LiN2
Molecular Weight242.58 g/mol
Exact Mass242.09
IUPAC Namelithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride
SMILESCl.NN1CCC(C(F)(F)F)CC1.[AlH3].[H-].[Li+]
InChIInChI=1S/C6H11F3N2.Al.ClH.Li.4H/c7-6(8,9)5-1-3-11(10)4-2-5;;;;;;;/h5H,1-4,10H2;;1H;;;;;/q;;;+1;;;;-1
InChIKeyZIHUEIXMACNFTO-UHFFFAOYSA-N
XLogP-2.51
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.58
LogP ≤ 5-2.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride?
The IUPAC name of lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride (CID 173354078) is lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride.
What is the SMILES notation for lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride?
The canonical SMILES for lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride is Cl.NN1CCC(C(F)(F)F)CC1.[AlH3].[H-].[Li+].
What is the InChIKey of lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride?
The InChIKey is ZIHUEIXMACNFTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2.Al.ClH.Li.4H/c7-6(8,9)5-1-3-11(10)4-2-5;;;;;;;/h5H,1-4,10H2;;1H;;;;;/q;;;+1;;;;-1.
What are the key properties of lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride?
lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride has a molecular weight of 242.58 g/mol, XLogP of -2.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;alumane;hydride;4-(trifluoromethyl)piperidin-1-amine;hydrochloride is sourced from PubChem (CID 173354078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).