lithium 3-aminopropylazanide

C3H9LiN2 — CID 11274963

IUPAClithium 3-aminopropylazanide
SMILES[Li+].[NH-]CCCN
InChIInChI=1S/C3H9N2.Li/c4-2-1-3-5;/h4H,1-3,5H2;/q-1;+1
InChIKeyIQOPQXOMSGYJDV-UHFFFAOYSA-N
MW80.06 g/mol
LogP-2.61
Rot. Bonds2

About lithium 3-aminopropylazanide

lithium 3-aminopropylazanide (PubChem CID 11274963) has the molecular formula C3H9LiN2 and a molecular weight of 80.06 g/mol. Its IUPAC name is lithium 3-aminopropylazanide.

Molecular Properties

Compound Namelithium 3-aminopropylazanide
PubChem CID11274963
Molecular FormulaC3H9LiN2
Molecular Weight80.06 g/mol
Exact Mass80.09
IUPAC Namelithium 3-aminopropylazanide
SMILES[Li+].[NH-]CCCN
InChIInChI=1S/C3H9N2.Li/c4-2-1-3-5;/h4H,1-3,5H2;/q-1;+1
InChIKeyIQOPQXOMSGYJDV-UHFFFAOYSA-N
XLogP-2.61
TPSA49.82 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50080.06
LogP ≤ 5-2.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium 3-aminopropylazanide?
The IUPAC name of lithium 3-aminopropylazanide (CID 11274963) is lithium 3-aminopropylazanide.
What is the SMILES notation for lithium 3-aminopropylazanide?
The canonical SMILES for lithium 3-aminopropylazanide is [Li+].[NH-]CCCN.
What is the InChIKey of lithium 3-aminopropylazanide?
The InChIKey is IQOPQXOMSGYJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N2.Li/c4-2-1-3-5;/h4H,1-3,5H2;/q-1;+1.
What are the key properties of lithium 3-aminopropylazanide?
lithium 3-aminopropylazanide has a molecular weight of 80.06 g/mol, XLogP of -2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 3-aminopropylazanide is sourced from PubChem (CID 11274963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).