lithium 2,4-ditert-butylimidazol-3-ide

C11H19LiN2 — CID 158739059

IUPAClithium 2,4-ditert-butylimidazol-3-ide
SMILESCC(C)(C)c1cnc(C(C)(C)C)[n-]1.[Li+]
InChIInChI=1S/C11H19N2.Li/c1-10(2,3)8-7-12-9(13-8)11(4,5)6;/h7H,1-6H3;/q-1;+1
InChIKeyIMAZYMLZTZSVJP-UHFFFAOYSA-N
MW186.23 g/mol
LogP-0.36
Rot. Bonds

About lithium 2,4-ditert-butylimidazol-3-ide

lithium 2,4-ditert-butylimidazol-3-ide (PubChem CID 158739059) has the molecular formula C11H19LiN2 and a molecular weight of 186.23 g/mol. Its IUPAC name is lithium 2,4-ditert-butylimidazol-3-ide.

Molecular Properties

Compound Namelithium 2,4-ditert-butylimidazol-3-ide
PubChem CID158739059
Molecular FormulaC11H19LiN2
Molecular Weight186.23 g/mol
Exact Mass186.17
IUPAC Namelithium 2,4-ditert-butylimidazol-3-ide
SMILESCC(C)(C)c1cnc(C(C)(C)C)[n-]1.[Li+]
InChIInChI=1S/C11H19N2.Li/c1-10(2,3)8-7-12-9(13-8)11(4,5)6;/h7H,1-6H3;/q-1;+1
InChIKeyIMAZYMLZTZSVJP-UHFFFAOYSA-N
XLogP-0.36
TPSA26.99 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 5-0.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-tert-butyl-5-ethylsulfonylpyridine
CID 146657361
chromium(2+);bis(2,5-ditert-butylpyrrol-1-ide)
CID 139164166
2-tert-butylpyridine;ethane;methane
CID 143332153
(5-tert-butyl-1,3-thiazol-2-yl)-methyl-methylidene-oxo-λ6-sulfane
CID 157369566
2,5-ditert-butylpyridine;propane
CID 158805083
6-tert-butylpyridine-3-carboxamide;ethane
CID 144695705
6-tert-butyl-N-methyl-N-(1,3,4-thiadiazol-2-yl)pyridine-3-sulfonamide
CID 146103871
2-(6-tert-butyl-3-pyridinyl)acetic acid
CID 58436565
2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide
CID 119305616
(2-tert-butylpyrimidin-5-yl)-imino-methyl-oxo-λ6-sulfane
CID 153306286
tetrakis(copper(1+));tetrakis(3,5-ditert-butylpyrazol-1-ide)
CID 11423212
(6-tert-butyl-3-pyridinyl) carbamate
CID 175536069

Frequently Asked Questions

What is the IUPAC name of lithium 2,4-ditert-butylimidazol-3-ide?
The IUPAC name of lithium 2,4-ditert-butylimidazol-3-ide (CID 158739059) is lithium 2,4-ditert-butylimidazol-3-ide.
What is the SMILES notation for lithium 2,4-ditert-butylimidazol-3-ide?
The canonical SMILES for lithium 2,4-ditert-butylimidazol-3-ide is CC(C)(C)c1cnc(C(C)(C)C)[n-]1.[Li+].
What is the InChIKey of lithium 2,4-ditert-butylimidazol-3-ide?
The InChIKey is IMAZYMLZTZSVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N2.Li/c1-10(2,3)8-7-12-9(13-8)11(4,5)6;/h7H,1-6H3;/q-1;+1.
What are the key properties of lithium 2,4-ditert-butylimidazol-3-ide?
lithium 2,4-ditert-butylimidazol-3-ide has a molecular weight of 186.23 g/mol, XLogP of -0.36, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2,4-ditert-butylimidazol-3-ide is sourced from PubChem (CID 158739059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).