2-ethenyl-5-methoxy-N,N-dimethylaniline

C11H15NO — CID 170076614

IUPAC2-ethenyl-5-methoxy-N,N-dimethylaniline
SMILESC=Cc1ccc(OC)cc1N(C)C
InChIInChI=1S/C11H15NO/c1-5-9-6-7-10(13-4)8-11(9)12(2)3/h5-8H,1H2,2-4H3
InChIKeyJATGIZAOLSJZPB-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.40
Rot. Bonds3

About 2-ethenyl-5-methoxy-N,N-dimethylaniline

2-ethenyl-5-methoxy-N,N-dimethylaniline (PubChem CID 170076614) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-ethenyl-5-methoxy-N,N-dimethylaniline.

Molecular Properties

Compound Name2-ethenyl-5-methoxy-N,N-dimethylaniline
PubChem CID170076614
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-ethenyl-5-methoxy-N,N-dimethylaniline
SMILESC=Cc1ccc(OC)cc1N(C)C
InChIInChI=1S/C11H15NO/c1-5-9-6-7-10(13-4)8-11(9)12(2)3/h5-8H,1H2,2-4H3
InChIKeyJATGIZAOLSJZPB-UHFFFAOYSA-N
XLogP2.40
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-5-methoxy-N,N-dimethylaniline?
The IUPAC name of 2-ethenyl-5-methoxy-N,N-dimethylaniline (CID 170076614) is 2-ethenyl-5-methoxy-N,N-dimethylaniline.
What is the SMILES notation for 2-ethenyl-5-methoxy-N,N-dimethylaniline?
The canonical SMILES for 2-ethenyl-5-methoxy-N,N-dimethylaniline is C=Cc1ccc(OC)cc1N(C)C.
What is the InChIKey of 2-ethenyl-5-methoxy-N,N-dimethylaniline?
The InChIKey is JATGIZAOLSJZPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-5-9-6-7-10(13-4)8-11(9)12(2)3/h5-8H,1H2,2-4H3.
What are the key properties of 2-ethenyl-5-methoxy-N,N-dimethylaniline?
2-ethenyl-5-methoxy-N,N-dimethylaniline has a molecular weight of 177.25 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-methoxy-N,N-dimethylaniline is sourced from PubChem (CID 170076614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).