2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine

C19H19N2P — CID 10979688

IUPAC2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine
SMILESCN(C)c1ccnc(P(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C19H19N2P/c1-21(2)16-13-14-20-19(15-16)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,1-2H3
InChIKeyHHPQHACDGUIVSX-UHFFFAOYSA-N
MW306.35 g/mol
LogP2.91
Rot. Bonds4

About 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine

2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine (PubChem CID 10979688) has the molecular formula C19H19N2P and a molecular weight of 306.35 g/mol. Its IUPAC name is 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine.

Molecular Properties

Compound Name2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine
PubChem CID10979688
Molecular FormulaC19H19N2P
Molecular Weight306.35 g/mol
Exact Mass306.13
IUPAC Name2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine
SMILESCN(C)c1ccnc(P(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C19H19N2P/c1-21(2)16-13-14-20-19(15-16)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,1-2H3
InChIKeyHHPQHACDGUIVSX-UHFFFAOYSA-N
XLogP2.91
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 52.91
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 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine?
The IUPAC name of 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine (CID 10979688) is 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine.
What is the SMILES notation for 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine?
The canonical SMILES for 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine is CN(C)c1ccnc(P(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine?
The InChIKey is HHPQHACDGUIVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N2P/c1-21(2)16-13-14-20-19(15-16)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15H,1-2H3.
What are the key properties of 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine?
2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine has a molecular weight of 306.35 g/mol, XLogP of 2.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-N,N-dimethylpyridin-4-amine is sourced from PubChem (CID 10979688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).