lithium (2,4-dimethylpentan-3-ylideneamino)azanide

C7H15LiN2 — CID 134881469

IUPAClithium (2,4-dimethylpentan-3-ylideneamino)azanide
SMILESCC(C)C(=N[NH-])C(C)C.[Li+]
InChIInChI=1S/C7H15N2.Li/c1-5(2)7(9-8)6(3)4;/h5-6,8H,1-4H3;/q-1;+1
InChIKeyOFAGNVMFBUFJTL-UHFFFAOYSA-N
MW134.15 g/mol
LogP-0.29
Rot. Bonds2

About lithium (2,4-dimethylpentan-3-ylideneamino)azanide

lithium (2,4-dimethylpentan-3-ylideneamino)azanide (PubChem CID 134881469) has the molecular formula C7H15LiN2 and a molecular weight of 134.15 g/mol. Its IUPAC name is lithium (2,4-dimethylpentan-3-ylideneamino)azanide.

Molecular Properties

Compound Namelithium (2,4-dimethylpentan-3-ylideneamino)azanide
PubChem CID134881469
Molecular FormulaC7H15LiN2
Molecular Weight134.15 g/mol
Exact Mass134.14
IUPAC Namelithium (2,4-dimethylpentan-3-ylideneamino)azanide
SMILESCC(C)C(=N[NH-])C(C)C.[Li+]
InChIInChI=1S/C7H15N2.Li/c1-5(2)7(9-8)6(3)4;/h5-6,8H,1-4H3;/q-1;+1
InChIKeyOFAGNVMFBUFJTL-UHFFFAOYSA-N
XLogP-0.29
TPSA36.16 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.15
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-isothiocyanato-2,4-dimethylpentan-3-imine
CID 134862053
2,4-dimethyl-N-sulfanyloxypentan-3-imine
CID 166866795
(NZ)-N-(1,1,1-trifluoro-2,4-dimethylpentan-3-ylidene)hydroxylamine
CID 146656420
(2,4-dimethylpentan-3-ylideneamino) acetate
CID 129117701
cobalt;tetramethylphosphanium
CID 175561525
propan-2-ol;titanium;hydroiodide
CID 175242007
lithium;propan-2-ol;iodide
CID 161175112
lithium;hydride;3-methylbutan-2-one
CID 173095274
dilithium bis(2-methylpropanoate)
CID 86626069
lithium;hydride;bis(2-methylpropanoic acid)
CID 175577602
N-benzyl-2,4-dimethylpentan-3-imine
CID 15160187
sulfuric acid;tetramethylphosphanium
CID 87132357

Frequently Asked Questions

What is the IUPAC name of lithium (2,4-dimethylpentan-3-ylideneamino)azanide?
The IUPAC name of lithium (2,4-dimethylpentan-3-ylideneamino)azanide (CID 134881469) is lithium (2,4-dimethylpentan-3-ylideneamino)azanide.
What is the SMILES notation for lithium (2,4-dimethylpentan-3-ylideneamino)azanide?
The canonical SMILES for lithium (2,4-dimethylpentan-3-ylideneamino)azanide is CC(C)C(=N[NH-])C(C)C.[Li+].
What is the InChIKey of lithium (2,4-dimethylpentan-3-ylideneamino)azanide?
The InChIKey is OFAGNVMFBUFJTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N2.Li/c1-5(2)7(9-8)6(3)4;/h5-6,8H,1-4H3;/q-1;+1.
What are the key properties of lithium (2,4-dimethylpentan-3-ylideneamino)azanide?
lithium (2,4-dimethylpentan-3-ylideneamino)azanide has a molecular weight of 134.15 g/mol, XLogP of -0.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium (2,4-dimethylpentan-3-ylideneamino)azanide is sourced from PubChem (CID 134881469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).