4-diethylphosphanyl-N,N-dimethylaniline

C12H20NP — CID 23414295

IUPAC4-diethylphosphanyl-N,N-dimethylaniline
SMILESCCP(CC)c1ccc(N(C)C)cc1
InChIInChI=1S/C12H20NP/c1-5-14(6-2)12-9-7-11(8-10-12)13(3)4/h7-10H,5-6H2,1-4H3
InChIKeyFMNOWZMFKYVARU-UHFFFAOYSA-N
MW209.27 g/mol
LogP2.90
Rot. Bonds4

About 4-diethylphosphanyl-N,N-dimethylaniline

4-diethylphosphanyl-N,N-dimethylaniline (PubChem CID 23414295) has the molecular formula C12H20NP and a molecular weight of 209.27 g/mol. Its IUPAC name is 4-diethylphosphanyl-N,N-dimethylaniline.

Molecular Properties

Compound Name4-diethylphosphanyl-N,N-dimethylaniline
PubChem CID23414295
Molecular FormulaC12H20NP
Molecular Weight209.27 g/mol
Exact Mass209.13
IUPAC Name4-diethylphosphanyl-N,N-dimethylaniline
SMILESCCP(CC)c1ccc(N(C)C)cc1
InChIInChI=1S/C12H20NP/c1-5-14(6-2)12-9-7-11(8-10-12)13(3)4/h7-10H,5-6H2,1-4H3
InChIKeyFMNOWZMFKYVARU-UHFFFAOYSA-N
XLogP2.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 52.90
H-Bond Donors ≤ 50
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 4-diethylphosphanyl-N,N-dimethylaniline?
The IUPAC name of 4-diethylphosphanyl-N,N-dimethylaniline (CID 23414295) is 4-diethylphosphanyl-N,N-dimethylaniline.
What is the SMILES notation for 4-diethylphosphanyl-N,N-dimethylaniline?
The canonical SMILES for 4-diethylphosphanyl-N,N-dimethylaniline is CCP(CC)c1ccc(N(C)C)cc1.
What is the InChIKey of 4-diethylphosphanyl-N,N-dimethylaniline?
The InChIKey is FMNOWZMFKYVARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20NP/c1-5-14(6-2)12-9-7-11(8-10-12)13(3)4/h7-10H,5-6H2,1-4H3.
What are the key properties of 4-diethylphosphanyl-N,N-dimethylaniline?
4-diethylphosphanyl-N,N-dimethylaniline has a molecular weight of 209.27 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-diethylphosphanyl-N,N-dimethylaniline is sourced from PubChem (CID 23414295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).