dilithium;benzylazanide;oxolane

C18H24Li2N2O — CID 139183726

IUPACdilithium;benzylazanide;oxolane
SMILESC1CCOC1.[Li+].[Li+].[NH-]Cc1ccccc1.[NH-]Cc1ccccc1
InChIInChI=1S/2C7H8N.C4H8O.2Li/c2*8-6-7-4-2-1-3-5-7;1-2-4-5-3-1;;/h2*1-5,8H,6H2;1-4H2;;/q2*-1;;2*+1
InChIKeyRFGXXAGHVTTZOV-UHFFFAOYSA-N
MW298.28 g/mol
LogP-0.72
Rot. Bonds2

About dilithium;benzylazanide;oxolane

dilithium;benzylazanide;oxolane (PubChem CID 139183726) has the molecular formula C18H24Li2N2O and a molecular weight of 298.28 g/mol. Its IUPAC name is dilithium;benzylazanide;oxolane.

Molecular Properties

Compound Namedilithium;benzylazanide;oxolane
PubChem CID139183726
Molecular FormulaC18H24Li2N2O
Molecular Weight298.28 g/mol
Exact Mass298.22
IUPAC Namedilithium;benzylazanide;oxolane
SMILESC1CCOC1.[Li+].[Li+].[NH-]Cc1ccccc1.[NH-]Cc1ccccc1
InChIInChI=1S/2C7H8N.C4H8O.2Li/c2*8-6-7-4-2-1-3-5-7;1-2-4-5-3-1;;/h2*1-5,8H,6H2;1-4H2;;/q2*-1;;2*+1
InChIKeyRFGXXAGHVTTZOV-UHFFFAOYSA-N
XLogP-0.72
TPSA56.83 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 5-0.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of dilithium;benzylazanide;oxolane?
The IUPAC name of dilithium;benzylazanide;oxolane (CID 139183726) is dilithium;benzylazanide;oxolane.
What is the SMILES notation for dilithium;benzylazanide;oxolane?
The canonical SMILES for dilithium;benzylazanide;oxolane is C1CCOC1.[Li+].[Li+].[NH-]Cc1ccccc1.[NH-]Cc1ccccc1.
What is the InChIKey of dilithium;benzylazanide;oxolane?
The InChIKey is RFGXXAGHVTTZOV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H8N.C4H8O.2Li/c2*8-6-7-4-2-1-3-5-7;1-2-4-5-3-1;;/h2*1-5,8H,6H2;1-4H2;;/q2*-1;;2*+1.
What are the key properties of dilithium;benzylazanide;oxolane?
dilithium;benzylazanide;oxolane has a molecular weight of 298.28 g/mol, XLogP of -0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;benzylazanide;oxolane is sourced from PubChem (CID 139183726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).