N,N-dimethyl-2-(2-phosphanylphenyl)aniline

C14H16NP — CID 66667785

IUPACN,N-dimethyl-2-(2-phosphanylphenyl)aniline
SMILESCN(C)c1ccccc1-c1ccccc1P
InChIInChI=1S/C14H16NP/c1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,16H2,1-2H3
InChIKeyDCZDKGSEQXBGSR-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.92
Rot. Bonds2

About N,N-dimethyl-2-(2-phosphanylphenyl)aniline

N,N-dimethyl-2-(2-phosphanylphenyl)aniline (PubChem CID 66667785) has the molecular formula C14H16NP and a molecular weight of 229.26 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-phosphanylphenyl)aniline.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-phosphanylphenyl)aniline
PubChem CID66667785
Molecular FormulaC14H16NP
Molecular Weight229.26 g/mol
Exact Mass229.10
IUPAC NameN,N-dimethyl-2-(2-phosphanylphenyl)aniline
SMILESCN(C)c1ccccc1-c1ccccc1P
InChIInChI=1S/C14H16NP/c1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,16H2,1-2H3
InChIKeyDCZDKGSEQXBGSR-UHFFFAOYSA-N
XLogP2.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.92
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 N,N-dimethyl-2-(2-phosphanylphenyl)aniline?
The IUPAC name of N,N-dimethyl-2-(2-phosphanylphenyl)aniline (CID 66667785) is N,N-dimethyl-2-(2-phosphanylphenyl)aniline.
What is the SMILES notation for N,N-dimethyl-2-(2-phosphanylphenyl)aniline?
The canonical SMILES for N,N-dimethyl-2-(2-phosphanylphenyl)aniline is CN(C)c1ccccc1-c1ccccc1P.
What is the InChIKey of N,N-dimethyl-2-(2-phosphanylphenyl)aniline?
The InChIKey is DCZDKGSEQXBGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16NP/c1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,16H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(2-phosphanylphenyl)aniline?
N,N-dimethyl-2-(2-phosphanylphenyl)aniline has a molecular weight of 229.26 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-phosphanylphenyl)aniline is sourced from PubChem (CID 66667785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).