lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine

C19H28BLiN2 — CID 135048648

IUPAClithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[CH2-]B(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C13H12B.C6H16N2.Li/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-7(2)5-6-8(3)4;/h2-11H,1H2;5-6H2,1-4H3;/q-1;;+1
InChIKeyUUJIMPHEIVRFGO-UHFFFAOYSA-N
MW302.20 g/mol
LogP-1.22
Rot. Bonds5

About lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine

lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine (PubChem CID 135048648) has the molecular formula C19H28BLiN2 and a molecular weight of 302.20 g/mol. Its IUPAC name is lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine.

Molecular Properties

Compound Namelithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine
PubChem CID135048648
Molecular FormulaC19H28BLiN2
Molecular Weight302.20 g/mol
Exact Mass302.25
IUPAC Namelithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[CH2-]B(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C13H12B.C6H16N2.Li/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-7(2)5-6-8(3)4;/h2-11H,1H2;5-6H2,1-4H3;/q-1;;+1
InChIKeyUUJIMPHEIVRFGO-UHFFFAOYSA-N
XLogP-1.22
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 5-1.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Methanaminium, N,N,N-trimethyl-, (T-4)-butyltriphenylborate(1-) (1:1)
CID 21924669
2-(Diphenylphosphanyl)-n,n-dimethylethanamine
CID 273266
Dimethylaminodiphenylborane
CID 5325045
(Diethylamino)diphenylborane
CID 5326245
N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine
CID 86152590
s-Butyltriphenylborate tetramethylammonium salt
CID 23110839
Bis(2-diethylaminoethyl)-(2-diphenylphosphinoethyl)amine
CID 54573019
N,N-dimethyl-3-[methyl(diphenyl)stannyl]propan-1-amine
CID 325473
Ethanamine, N-[(diphenylphosphino)methyl]-N-ethyl-
CID 4489219
Bis(dimethylamino)diphenylstannane
CID 12072383
N,N,N',N'-Tetraethyl-1-phenylboranediamine
CID 12776550
lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine
CID 13086799

Frequently Asked Questions

What is the IUPAC name of lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine?
The IUPAC name of lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine (CID 135048648) is lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine.
What is the SMILES notation for lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine?
The canonical SMILES for lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine is CN(C)CCN(C)C.[CH2-]B(c1ccccc1)c1ccccc1.[Li+].
What is the InChIKey of lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine?
The InChIKey is UUJIMPHEIVRFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12B.C6H16N2.Li/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-7(2)5-6-8(3)4;/h2-11H,1H2;5-6H2,1-4H3;/q-1;;+1.
What are the key properties of lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine?
lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine has a molecular weight of 302.20 g/mol, XLogP of -1.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;methanidyl(diphenyl)borane;N,N,N',N'-tetramethylethane-1,2-diamine is sourced from PubChem (CID 135048648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).