N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine

C17H23N2P — CID 86152590

IUPACN'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine
SMILESCN(C)CCN(C)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H23N2P/c1-18(2)14-15-19(3)20(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyTUHMABSUHPBSAB-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.53
Rot. Bonds6

About N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine

N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine (PubChem CID 86152590) has the molecular formula C17H23N2P and a molecular weight of 286.36 g/mol. Its IUPAC name is N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine
PubChem CID86152590
Molecular FormulaC17H23N2P
Molecular Weight286.36 g/mol
Exact Mass286.16
IUPAC NameN'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine
SMILESCN(C)CCN(C)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H23N2P/c1-18(2)14-15-19(3)20(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyTUHMABSUHPBSAB-UHFFFAOYSA-N
XLogP2.53
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine?
The IUPAC name of N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine (CID 86152590) is N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine.
What is the SMILES notation for N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine?
The canonical SMILES for N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine is CN(C)CCN(C)P(c1ccccc1)c1ccccc1.
What is the InChIKey of N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine?
The InChIKey is TUHMABSUHPBSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N2P/c1-18(2)14-15-19(3)20(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3.
What are the key properties of N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine?
N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine has a molecular weight of 286.36 g/mol, XLogP of 2.53, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine is sourced from PubChem (CID 86152590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).