(1R)-1-(2-diphenylphosphanylphenyl)ethanamine

C20H20NP — CID 71463645

IUPAC(1R)-1-(2-diphenylphosphanylphenyl)ethanamine
SMILESC[C@@H](N)c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20NP/c1-16(21)19-14-8-9-15-20(19)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16H,21H2,1H3/t16-/m1/s1
InChIKeyKPFJIPHGQGHIMM-MRXNPFEDSA-N
MW305.36 g/mol
LogP3.46
Rot. Bonds4

About (1R)-1-(2-diphenylphosphanylphenyl)ethanamine

(1R)-1-(2-diphenylphosphanylphenyl)ethanamine (PubChem CID 71463645) has the molecular formula C20H20NP and a molecular weight of 305.36 g/mol. Its IUPAC name is (1R)-1-(2-diphenylphosphanylphenyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(2-diphenylphosphanylphenyl)ethanamine
PubChem CID71463645
Molecular FormulaC20H20NP
Molecular Weight305.36 g/mol
Exact Mass305.13
IUPAC Name(1R)-1-(2-diphenylphosphanylphenyl)ethanamine
SMILESC[C@@H](N)c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20NP/c1-16(21)19-14-8-9-15-20(19)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16H,21H2,1H3/t16-/m1/s1
InChIKeyKPFJIPHGQGHIMM-MRXNPFEDSA-N
XLogP3.46
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-diphenylphosphanylphenyl)ethanamine?
The IUPAC name of (1R)-1-(2-diphenylphosphanylphenyl)ethanamine (CID 71463645) is (1R)-1-(2-diphenylphosphanylphenyl)ethanamine.
What is the SMILES notation for (1R)-1-(2-diphenylphosphanylphenyl)ethanamine?
The canonical SMILES for (1R)-1-(2-diphenylphosphanylphenyl)ethanamine is C[C@@H](N)c1ccccc1P(c1ccccc1)c1ccccc1.
What is the InChIKey of (1R)-1-(2-diphenylphosphanylphenyl)ethanamine?
The InChIKey is KPFJIPHGQGHIMM-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H20NP/c1-16(21)19-14-8-9-15-20(19)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16H,21H2,1H3/t16-/m1/s1.
What are the key properties of (1R)-1-(2-diphenylphosphanylphenyl)ethanamine?
(1R)-1-(2-diphenylphosphanylphenyl)ethanamine has a molecular weight of 305.36 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-diphenylphosphanylphenyl)ethanamine is sourced from PubChem (CID 71463645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).