lithium cyclopropylmethyl(propyl)azanide

C7H14LiN — CID 20660855

IUPAClithium cyclopropylmethyl(propyl)azanide
SMILESCCC[N-]CC1CC1.[Li+]
InChIInChI=1S/C7H14N.Li/c1-2-5-8-6-7-3-4-7;/h7H,2-6H2,1H3;/q-1;+1
InChIKeyXJLHLPZDMYQTLP-UHFFFAOYSA-N
MW119.14 g/mol
LogP-0.82
Rot. Bonds4

About lithium cyclopropylmethyl(propyl)azanide

lithium cyclopropylmethyl(propyl)azanide (PubChem CID 20660855) has the molecular formula C7H14LiN and a molecular weight of 119.14 g/mol. Its IUPAC name is lithium cyclopropylmethyl(propyl)azanide.

Molecular Properties

Compound Namelithium cyclopropylmethyl(propyl)azanide
PubChem CID20660855
Molecular FormulaC7H14LiN
Molecular Weight119.14 g/mol
Exact Mass119.13
IUPAC Namelithium cyclopropylmethyl(propyl)azanide
SMILESCCC[N-]CC1CC1.[Li+]
InChIInChI=1S/C7H14N.Li/c1-2-5-8-6-7-3-4-7;/h7H,2-6H2,1H3;/q-1;+1
InChIKeyXJLHLPZDMYQTLP-UHFFFAOYSA-N
XLogP-0.82
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-0.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze lithium cyclopropylmethyl(propyl)azanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of lithium cyclopropylmethyl(propyl)azanide?
The IUPAC name of lithium cyclopropylmethyl(propyl)azanide (CID 20660855) is lithium cyclopropylmethyl(propyl)azanide.
What is the SMILES notation for lithium cyclopropylmethyl(propyl)azanide?
The canonical SMILES for lithium cyclopropylmethyl(propyl)azanide is CCC[N-]CC1CC1.[Li+].
What is the InChIKey of lithium cyclopropylmethyl(propyl)azanide?
The InChIKey is XJLHLPZDMYQTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N.Li/c1-2-5-8-6-7-3-4-7;/h7H,2-6H2,1H3;/q-1;+1.
What are the key properties of lithium cyclopropylmethyl(propyl)azanide?
lithium cyclopropylmethyl(propyl)azanide has a molecular weight of 119.14 g/mol, XLogP of -0.82, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium cyclopropylmethyl(propyl)azanide is sourced from PubChem (CID 20660855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).