lithium ethane-1,2-diamine

C2H7LiN2 — CID 19825626

IUPAClithium ethane-1,2-diamine
SMILESN[CH-]CN.[Li+]
InChIInChI=1S/C2H7N2.Li/c3-1-2-4;/h1H,2-4H2;/q-1;+1
InChIKeyQDUICEMTRWLVND-UHFFFAOYSA-N
MW66.03 g/mol
LogP-3.93
Rot. Bonds1

About lithium ethane-1,2-diamine

lithium ethane-1,2-diamine (PubChem CID 19825626) has the molecular formula C2H7LiN2 and a molecular weight of 66.03 g/mol. Its IUPAC name is lithium ethane-1,2-diamine.

Molecular Properties

Compound Namelithium ethane-1,2-diamine
PubChem CID19825626
Molecular FormulaC2H7LiN2
Molecular Weight66.03 g/mol
Exact Mass66.08
IUPAC Namelithium ethane-1,2-diamine
SMILESN[CH-]CN.[Li+]
InChIInChI=1S/C2H7N2.Li/c3-1-2-4;/h1H,2-4H2;/q-1;+1
InChIKeyQDUICEMTRWLVND-UHFFFAOYSA-N
XLogP-3.93
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50066.03
LogP ≤ 5-3.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium ethane-1,2-diamine?
The IUPAC name of lithium ethane-1,2-diamine (CID 19825626) is lithium ethane-1,2-diamine.
What is the SMILES notation for lithium ethane-1,2-diamine?
The canonical SMILES for lithium ethane-1,2-diamine is N[CH-]CN.[Li+].
What is the InChIKey of lithium ethane-1,2-diamine?
The InChIKey is QDUICEMTRWLVND-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N2.Li/c3-1-2-4;/h1H,2-4H2;/q-1;+1.
What are the key properties of lithium ethane-1,2-diamine?
lithium ethane-1,2-diamine has a molecular weight of 66.03 g/mol, XLogP of -3.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium ethane-1,2-diamine is sourced from PubChem (CID 19825626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).