N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine

C16H21N2OP — CID 592300

IUPACN-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine
SMILESCN(C)P(=O)(c1ccc(-c2ccccc2)cc1)N(C)C
InChIInChI=1S/C16H21N2OP/c1-17(2)20(19,18(3)4)16-12-10-15(11-13-16)14-8-6-5-7-9-14/h5-13H,1-4H3
InChIKeyWCFJLLBUAROLRN-UHFFFAOYSA-N
MW288.33 g/mol
LogP3.30
Rot. Bonds4

About N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine

N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine (PubChem CID 592300) has the molecular formula C16H21N2OP and a molecular weight of 288.33 g/mol. Its IUPAC name is N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine
PubChem CID592300
Molecular FormulaC16H21N2OP
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC NameN-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine
SMILESCN(C)P(=O)(c1ccc(-c2ccccc2)cc1)N(C)C
InChIInChI=1S/C16H21N2OP/c1-17(2)20(19,18(3)4)16-12-10-15(11-13-16)14-8-6-5-7-9-14/h5-13H,1-4H3
InChIKeyWCFJLLBUAROLRN-UHFFFAOYSA-N
XLogP3.30
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(Di-tert-butylphosphino)biphenyl
CID 2734215
N-[dimethylamino-(2-methylphenyl)phosphanyl]-N-methylmethanamine
CID 11445605
Benzyl-tris(dimethylamino)phosphanium
CID 4145839
Benzylphosphonic bis(diethylamide)
CID 2785331
N-[diethylamino(9H-fluoren-9-yl)phosphoryl]-N-ethylethanamine
CID 11760072
Rbtvpzqzhhulrg-uhfffaoysa-
CID 12858937
1-Diethylamino-2,3-diphenylphosphirane
CID 14738776
2-[Azido-[2,4,6-tri(propan-2-yl)phenyl]phosphoryl]-1,3,5-tri(propan-2-yl)benzene
CID 14922824
(1R,2R)-N,N-diethyl-1-oxo-2,5-diphenyl-2,3-dihydro-1lambda5-phosphol-1-amine
CID 25001005
N-[dimethylamino-(2-phenylphenyl)phosphanyl]-N-methylmethanamine
CID 86010997
(2R,5R)-N,N-diethyl-1-oxo-2,5-diphenyl-1lambda5-phospholan-1-amine
CID 134837425
Phosphine oxide, (1,1-dimethylethyl)bis(2-methylphenyl)-
CID 5250746

Frequently Asked Questions

What is the IUPAC name of N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine?
The IUPAC name of N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine (CID 592300) is N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine.
What is the SMILES notation for N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine?
The canonical SMILES for N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine is CN(C)P(=O)(c1ccc(-c2ccccc2)cc1)N(C)C.
What is the InChIKey of N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine?
The InChIKey is WCFJLLBUAROLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N2OP/c1-17(2)20(19,18(3)4)16-12-10-15(11-13-16)14-8-6-5-7-9-14/h5-13H,1-4H3.
What are the key properties of N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine?
N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine has a molecular weight of 288.33 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethylamino-(4-phenylphenyl)phosphoryl]-N-methylmethanamine is sourced from PubChem (CID 592300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).