lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine

C22H35LiN4Si — CID 135049431

IUPAClithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine
SMILESCN(C)CCN(C)[Si](c1[c-]cccc1)(c1ccccc1)N(C)CCN(C)C.[Li+]
InChIInChI=1S/C22H35N4Si.Li/c1-23(2)17-19-25(5)27(21-13-9-7-10-14-21,22-15-11-8-12-16-22)26(6)20-18-24(3)4;/h7-15H,17-20H2,1-6H3;/q-1;+1
InChIKeyFGBUJYMDNSFBNN-UHFFFAOYSA-N
MW390.58 g/mol
LogP-1.97
Rot. Bonds10

About lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine

lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine (PubChem CID 135049431) has the molecular formula C22H35LiN4Si and a molecular weight of 390.58 g/mol. Its IUPAC name is lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine.

Molecular Properties

Compound Namelithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine
PubChem CID135049431
Molecular FormulaC22H35LiN4Si
Molecular Weight390.58 g/mol
Exact Mass390.28
IUPAC Namelithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine
SMILESCN(C)CCN(C)[Si](c1[c-]cccc1)(c1ccccc1)N(C)CCN(C)C.[Li+]
InChIInChI=1S/C22H35N4Si.Li/c1-23(2)17-19-25(5)27(21-13-9-7-10-14-21,22-15-11-8-12-16-22)26(6)20-18-24(3)4;/h7-15H,17-20H2,1-6H3;/q-1;+1
InChIKeyFGBUJYMDNSFBNN-UHFFFAOYSA-N
XLogP-1.97
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.58
LogP ≤ 5-1.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine with MolForge

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Related Compounds

lithium fluoro-diphenyl-phenylsilane
CID 177391118
lithium N,N,N'-trimethyl-N'-(phenylmethyl)ethane-1,2-diamine
CID 15822463
2-[2-(dimethylamino)ethoxy-diphenylsilyl]oxy-N,N-dimethylethanamine
CID 23278623
CID 134889697
CID 134889697
ethane;N,N,N'-trimethyl-N'-phenylethane-1,2-diamine
CID 177320801
1-[dimethyl(phenyl)silyl]-N,N-dimethylmethanamine
CID 12549234
N-[[formyl(methyl)amino]-diphenylsilyl]-N-methylformamide
CID 20561254
benzene;carbanide;N,N-dimethyl-1-phenylmethanamine;tin(4+);bromide
CID 54725612
acetic acid;carbanide;N,N-dimethyl-1-phenylmethanamine;palladium
CID 59987071
N,N,N'-trimethyl-N'-[2-(N-methylanilino)ethyl]ethane-1,2-diamine
CID 70599954
ethyl(triphenyl)silane
CID 5219688
N-methyl-N-phenylaniline;yttrium
CID 59953259

Frequently Asked Questions

What is the IUPAC name of lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine?
The IUPAC name of lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine (CID 135049431) is lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine.
What is the SMILES notation for lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine?
The canonical SMILES for lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine is CN(C)CCN(C)[Si](c1[c-]cccc1)(c1ccccc1)N(C)CCN(C)C.[Li+].
What is the InChIKey of lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine?
The InChIKey is FGBUJYMDNSFBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N4Si.Li/c1-23(2)17-19-25(5)27(21-13-9-7-10-14-21,22-15-11-8-12-16-22)26(6)20-18-24(3)4;/h7-15H,17-20H2,1-6H3;/q-1;+1.
What are the key properties of lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine?
lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine has a molecular weight of 390.58 g/mol, XLogP of -1.97, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium N'-[[2-(dimethylamino)ethyl-methylamino]-phenyl-phenylsilyl]-N,N,N'-trimethylethane-1,2-diamine is sourced from PubChem (CID 135049431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).