N,N-dimethylaniline;N,N-diphenylaniline

C26H26N2 — CID 159990775

IUPACN,N-dimethylaniline;N,N-diphenylaniline
SMILESCN(C)c1ccccc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15N.C8H11N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)8-6-4-3-5-7-8/h1-15H;3-7H,1-2H3
InChIKeyOGXOLXLDKJHODA-UHFFFAOYSA-N
MW366.51 g/mol
LogP6.91
Rot. Bonds4

About N,N-dimethylaniline;N,N-diphenylaniline

N,N-dimethylaniline;N,N-diphenylaniline (PubChem CID 159990775) has the molecular formula C26H26N2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N,N-dimethylaniline;N,N-diphenylaniline.

Molecular Properties

Compound NameN,N-dimethylaniline;N,N-diphenylaniline
PubChem CID159990775
Molecular FormulaC26H26N2
Molecular Weight366.51 g/mol
Exact Mass366.21
IUPAC NameN,N-dimethylaniline;N,N-diphenylaniline
SMILESCN(C)c1ccccc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15N.C8H11N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)8-6-4-3-5-7-8/h1-15H;3-7H,1-2H3
InChIKeyOGXOLXLDKJHODA-UHFFFAOYSA-N
XLogP6.91
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.51
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylaniline;N,N-diphenylaniline?
The IUPAC name of N,N-dimethylaniline;N,N-diphenylaniline (CID 159990775) is N,N-dimethylaniline;N,N-diphenylaniline.
What is the SMILES notation for N,N-dimethylaniline;N,N-diphenylaniline?
The canonical SMILES for N,N-dimethylaniline;N,N-diphenylaniline is CN(C)c1ccccc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N,N-dimethylaniline;N,N-diphenylaniline?
The InChIKey is OGXOLXLDKJHODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N.C8H11N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)8-6-4-3-5-7-8/h1-15H;3-7H,1-2H3.
What are the key properties of N,N-dimethylaniline;N,N-diphenylaniline?
N,N-dimethylaniline;N,N-diphenylaniline has a molecular weight of 366.51 g/mol, XLogP of 6.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylaniline;N,N-diphenylaniline is sourced from PubChem (CID 159990775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).