lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine

C10H15LiN2 — CID 11116474

IUPAClithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine
SMILESCN(C)c1[c-]c(N(C)C)ccc1.[Li+]
InChIInChI=1S/C10H15N2.Li/c1-11(2)9-6-5-7-10(8-9)12(3)4;/h5-7H,1-4H3;/q-1;+1
InChIKeyKGNJDWGFHUJIIX-UHFFFAOYSA-N
MW170.18 g/mol
LogP-1.38
Rot. Bonds2

About lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine

lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine (PubChem CID 11116474) has the molecular formula C10H15LiN2 and a molecular weight of 170.18 g/mol. Its IUPAC name is lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine.

Molecular Properties

Compound Namelithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine
PubChem CID11116474
Molecular FormulaC10H15LiN2
Molecular Weight170.18 g/mol
Exact Mass170.14
IUPAC Namelithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine
SMILESCN(C)c1[c-]c(N(C)C)ccc1.[Li+]
InChIInChI=1S/C10H15N2.Li/c1-11(2)9-6-5-7-10(8-9)12(3)4;/h5-7H,1-4H3;/q-1;+1
InChIKeyKGNJDWGFHUJIIX-UHFFFAOYSA-N
XLogP-1.38
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 5-1.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Bromo[4-(dimethylamino)phenyl]magnesium
CID 10933129
magnesium;N,N-dimethylaniline;bromide
CID 15971454
4-(N,N-Dimethyl)aniline magnesium bromide
CID 54723488
[p-(Dimethylamino)phenyl]lithium
CID 83217
Lithium 2-(dimethylamino)benzen-1-ide
CID 12620685
C8H10BrMgN
CID 72731801
(4-(dimethylamino)phenyl)zinc(II) chloride
CID 10036436
magnesium;N,N-dimethylaniline;chloride
CID 10910146
Magnesium bromide 3-(dimethylamino)benzen-1-ide (1/1/1)
CID 12887370
2-(N,N-Dimethylamino)phenylmagnesium bromide, 0.50 M in THF
CID 14469165
N-methyl-2-methylidenepyridine
CID 14963017
1-Cyano-4-dimethylaminopyridine
CID 17889658

Frequently Asked Questions

What is the IUPAC name of lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine?
The IUPAC name of lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine (CID 11116474) is lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine.
What is the SMILES notation for lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine?
The canonical SMILES for lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine is CN(C)c1[c-]c(N(C)C)ccc1.[Li+].
What is the InChIKey of lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine?
The InChIKey is KGNJDWGFHUJIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N2.Li/c1-11(2)9-6-5-7-10(8-9)12(3)4;/h5-7H,1-4H3;/q-1;+1.
What are the key properties of lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine?
lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine has a molecular weight of 170.18 g/mol, XLogP of -1.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 1-N,1-N,3-N,3-N-tetramethylbenzene-2-ide-1,3-diamine is sourced from PubChem (CID 11116474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).