2-[4-(dimethylamino)phenyl]-N,N-diethylaniline

C18H24N2 — CID 173255572

IUPAC2-[4-(dimethylamino)phenyl]-N,N-diethylaniline
SMILESCCN(CC)c1ccccc1-c1ccc(N(C)C)cc1
InChIInChI=1S/C18H24N2/c1-5-20(6-2)18-10-8-7-9-17(18)15-11-13-16(14-12-15)19(3)4/h7-14H,5-6H2,1-4H3
InChIKeyRIYAPBLCJOJZLI-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.27
Rot. Bonds5

About 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline

2-[4-(dimethylamino)phenyl]-N,N-diethylaniline (PubChem CID 173255572) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline.

Molecular Properties

Compound Name2-[4-(dimethylamino)phenyl]-N,N-diethylaniline
PubChem CID173255572
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2-[4-(dimethylamino)phenyl]-N,N-diethylaniline
SMILESCCN(CC)c1ccccc1-c1ccc(N(C)C)cc1
InChIInChI=1S/C18H24N2/c1-5-20(6-2)18-10-8-7-9-17(18)15-11-13-16(14-12-15)19(3)4/h7-14H,5-6H2,1-4H3
InChIKeyRIYAPBLCJOJZLI-UHFFFAOYSA-N
XLogP4.27
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline?
The IUPAC name of 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline (CID 173255572) is 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline.
What is the SMILES notation for 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline?
The canonical SMILES for 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline is CCN(CC)c1ccccc1-c1ccc(N(C)C)cc1.
What is the InChIKey of 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline?
The InChIKey is RIYAPBLCJOJZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-5-20(6-2)18-10-8-7-9-17(18)15-11-13-16(14-12-15)19(3)4/h7-14H,5-6H2,1-4H3.
What are the key properties of 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline?
2-[4-(dimethylamino)phenyl]-N,N-diethylaniline has a molecular weight of 268.40 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)phenyl]-N,N-diethylaniline is sourced from PubChem (CID 173255572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).