N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine

C16H20N3P — CID 12890555

IUPACN,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine
SMILESCN(C)P1N(c2ccccc2)CCN1c1ccccc1
InChIInChI=1S/C16H20N3P/c1-17(2)20-18(15-9-5-3-6-10-15)13-14-19(20)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKeyLMEXDFDHHJXKSD-UHFFFAOYSA-N
MW285.33 g/mol
LogP3.80
Rot. Bonds3

About N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine

N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine (PubChem CID 12890555) has the molecular formula C16H20N3P and a molecular weight of 285.33 g/mol. Its IUPAC name is N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine
PubChem CID12890555
Molecular FormulaC16H20N3P
Molecular Weight285.33 g/mol
Exact Mass285.14
IUPAC NameN,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine
SMILESCN(C)P1N(c2ccccc2)CCN1c1ccccc1
InChIInChI=1S/C16H20N3P/c1-17(2)20-18(15-9-5-3-6-10-15)13-14-19(20)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKeyLMEXDFDHHJXKSD-UHFFFAOYSA-N
XLogP3.80
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,1-Dimethyl-4-phenylpiperazinium iodide
CID 5911
N,N'-Diphenylethylenediamine
CID 67422
1,2-Ethanediamine, N1-ethyl-N2,N2-dimethyl-N1-phenyl-
CID 33984
Solvent Yellow 56
CID 17204
Phenbenzamine
CID 13751
N,N-Dibutylaniline
CID 61154
Methyldiphenylamine
CID 11098
Histapyrrodine
CID 68122
Dimethylphenylpiperazinium
CID 1316
1-Phenyl-4-propylpiperazine
CID 422923
Piperazine, 1-methyl-4-phenyl-
CID 200991
Octyldiphenylamine
CID 66575

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine?
The IUPAC name of N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine (CID 12890555) is N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine.
What is the SMILES notation for N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine?
The canonical SMILES for N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine is CN(C)P1N(c2ccccc2)CCN1c1ccccc1.
What is the InChIKey of N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine?
The InChIKey is LMEXDFDHHJXKSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N3P/c1-17(2)20-18(15-9-5-3-6-10-15)13-14-19(20)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3.
What are the key properties of N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine?
N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine has a molecular weight of 285.33 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1,3-diphenyl-1,3,2-diazaphospholidin-2-amine is sourced from PubChem (CID 12890555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).