N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine

C26H24NP — CID 24878642

IUPACN-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine
SMILESc1ccc(CNCc2ccc(P(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H24NP/c1-4-10-22(11-5-1)20-27-21-23-16-18-26(19-17-23)28(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-19,27H,20-21H2
InChIKeyYJHXOMVNXQZOCZ-UHFFFAOYSA-N
MW381.46 g/mol
LogP4.73
Rot. Bonds7

About N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine

N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine (PubChem CID 24878642) has the molecular formula C26H24NP and a molecular weight of 381.46 g/mol. Its IUPAC name is N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine
PubChem CID24878642
Molecular FormulaC26H24NP
Molecular Weight381.46 g/mol
Exact Mass381.16
IUPAC NameN-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine
SMILESc1ccc(CNCc2ccc(P(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H24NP/c1-4-10-22(11-5-1)20-27-21-23-16-18-26(19-17-23)28(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-19,27H,20-21H2
InChIKeyYJHXOMVNXQZOCZ-UHFFFAOYSA-N
XLogP4.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-1-phenylmethanamine;hydrate
CID 173452781
N-benzyl-1-phenylmethanamine;λ2-stannane;hydrochloride
CID 174862297
N-[[4-[[4-[(benzylamino)methyl]phenyl]methyl]phenyl]methyl]-1-phenylmethanamine;dihydrochloride
CID 24837605
triphenylphosphane
CID 139056248
N-benzyl-1-phenylmethanamine;dichlorotitanium
CID 174633271
phenylmethanol;triphenylphosphane
CID 172697327
iron dihydride;tetrakis(triphenylphosphane)
CID 172730134
CID 87948921
CID 87948921
tris(triphenylphosphane);hydrobromide
CID 172722268
tris(triphenylphosphane);trihydrochloride
CID 173282987
palladium;bis(triphenylphosphane)
CID 10122028
triphenylphosphane;yttrium
CID 139917776

Frequently Asked Questions

What is the IUPAC name of N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine?
The IUPAC name of N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine (CID 24878642) is N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine is c1ccc(CNCc2ccc(P(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine?
The InChIKey is YJHXOMVNXQZOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24NP/c1-4-10-22(11-5-1)20-27-21-23-16-18-26(19-17-23)28(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-19,27H,20-21H2.
What are the key properties of N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine?
N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine has a molecular weight of 381.46 g/mol, XLogP of 4.73, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-diphenylphosphanylphenyl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 24878642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).