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

C19H28LiN2P — CID 13086799

IUPAClithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[CH2-]P(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C13H12P.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
InChIKeyPXCGITFHLAHOCN-UHFFFAOYSA-N
MW322.36 g/mol
LogP0.02
Rot. Bonds5

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

lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine (PubChem CID 13086799) has the molecular formula C19H28LiN2P and a molecular weight of 322.36 g/mol. Its IUPAC name is lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine.

Molecular Properties

Compound Namelithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine
PubChem CID13086799
Molecular FormulaC19H28LiN2P
Molecular Weight322.36 g/mol
Exact Mass322.22
IUPAC Namelithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine
SMILESCN(C)CCN(C)C.[CH2-]P(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C13H12P.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
InChIKeyPXCGITFHLAHOCN-UHFFFAOYSA-N
XLogP0.02
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine?
The IUPAC name of lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine (CID 13086799) is lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine.
What is the SMILES notation for lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine?
The canonical SMILES for lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine is CN(C)CCN(C)C.[CH2-]P(c1ccccc1)c1ccccc1.[Li+].
What is the InChIKey of lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine?
The InChIKey is PXCGITFHLAHOCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12P.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)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine?
lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine has a molecular weight of 322.36 g/mol, XLogP of 0.02, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;methanidyl(diphenyl)phosphane;N,N,N',N'-tetramethylethane-1,2-diamine is sourced from PubChem (CID 13086799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).