N-(4-ethoxyphenyl)-N,4-dimethylaniline

C16H19NO — CID 20575987

IUPACN-(4-ethoxyphenyl)-N,4-dimethylaniline
SMILESCCOc1ccc(N(C)c2ccc(C)cc2)cc1
InChIInChI=1S/C16H19NO/c1-4-18-16-11-9-15(10-12-16)17(3)14-7-5-13(2)6-8-14/h5-12H,4H2,1-3H3
InChIKeyQSWMMEZHWMKYCJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.16
Rot. Bonds4

About N-(4-ethoxyphenyl)-N,4-dimethylaniline

N-(4-ethoxyphenyl)-N,4-dimethylaniline (PubChem CID 20575987) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N,4-dimethylaniline.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N,4-dimethylaniline
PubChem CID20575987
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-(4-ethoxyphenyl)-N,4-dimethylaniline
SMILESCCOc1ccc(N(C)c2ccc(C)cc2)cc1
InChIInChI=1S/C16H19NO/c1-4-18-16-11-9-15(10-12-16)17(3)14-7-5-13(2)6-8-14/h5-12H,4H2,1-3H3
InChIKeyQSWMMEZHWMKYCJ-UHFFFAOYSA-N
XLogP4.16
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(4-ethoxyphenyl)-N,4-dimethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N,4-dimethylaniline?
The IUPAC name of N-(4-ethoxyphenyl)-N,4-dimethylaniline (CID 20575987) is N-(4-ethoxyphenyl)-N,4-dimethylaniline.
What is the SMILES notation for N-(4-ethoxyphenyl)-N,4-dimethylaniline?
The canonical SMILES for N-(4-ethoxyphenyl)-N,4-dimethylaniline is CCOc1ccc(N(C)c2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N,4-dimethylaniline?
The InChIKey is QSWMMEZHWMKYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-4-18-16-11-9-15(10-12-16)17(3)14-7-5-13(2)6-8-14/h5-12H,4H2,1-3H3.
What are the key properties of N-(4-ethoxyphenyl)-N,4-dimethylaniline?
N-(4-ethoxyphenyl)-N,4-dimethylaniline has a molecular weight of 241.33 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N,4-dimethylaniline is sourced from PubChem (CID 20575987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).