1-(3-ethenylphenyl)-N,N-dimethylmethanamine

C11H15N — CID 3893079

IUPAC1-(3-ethenylphenyl)-N,N-dimethylmethanamine
SMILESC=Cc1cccc(CN(C)C)c1
InChIInChI=1S/C11H15N/c1-4-10-6-5-7-11(8-10)9-12(2)3/h4-8H,1,9H2,2-3H3
InChIKeyCGQMSVZSAGRUJH-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.39
Rot. Bonds3

About 1-(3-ethenylphenyl)-N,N-dimethylmethanamine

1-(3-ethenylphenyl)-N,N-dimethylmethanamine (PubChem CID 3893079) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 1-(3-ethenylphenyl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(3-ethenylphenyl)-N,N-dimethylmethanamine
PubChem CID3893079
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name1-(3-ethenylphenyl)-N,N-dimethylmethanamine
SMILESC=Cc1cccc(CN(C)C)c1
InChIInChI=1S/C11H15N/c1-4-10-6-5-7-11(8-10)9-12(2)3/h4-8H,1,9H2,2-3H3
InChIKeyCGQMSVZSAGRUJH-UHFFFAOYSA-N
XLogP2.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(3-ethenylphenyl)-N,N-dimethylmethanamine 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 1-(3-ethenylphenyl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(3-ethenylphenyl)-N,N-dimethylmethanamine (CID 3893079) is 1-(3-ethenylphenyl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(3-ethenylphenyl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(3-ethenylphenyl)-N,N-dimethylmethanamine is C=Cc1cccc(CN(C)C)c1.
What is the InChIKey of 1-(3-ethenylphenyl)-N,N-dimethylmethanamine?
The InChIKey is CGQMSVZSAGRUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-4-10-6-5-7-11(8-10)9-12(2)3/h4-8H,1,9H2,2-3H3.
What are the key properties of 1-(3-ethenylphenyl)-N,N-dimethylmethanamine?
1-(3-ethenylphenyl)-N,N-dimethylmethanamine has a molecular weight of 161.25 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethenylphenyl)-N,N-dimethylmethanamine is sourced from PubChem (CID 3893079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).