1-ethenyl-4-ethylbenzene;pyrrolidine

C14H21N — CID 174791153

IUPAC1-ethenyl-4-ethylbenzene;pyrrolidine
SMILESC1CCNC1.C=Cc1ccc(CC)cc1
InChIInChI=1S/C10H12.C4H9N/c1-3-9-5-7-10(4-2)8-6-9;1-2-4-5-3-1/h3,5-8H,1,4H2,2H3;5H,1-4H2
InChIKeyHHUQLMMDYJKITK-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.26
Rot. Bonds2

About 1-ethenyl-4-ethylbenzene;pyrrolidine

1-ethenyl-4-ethylbenzene;pyrrolidine (PubChem CID 174791153) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-ethenyl-4-ethylbenzene;pyrrolidine.

Molecular Properties

Compound Name1-ethenyl-4-ethylbenzene;pyrrolidine
PubChem CID174791153
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1-ethenyl-4-ethylbenzene;pyrrolidine
SMILESC1CCNC1.C=Cc1ccc(CC)cc1
InChIInChI=1S/C10H12.C4H9N/c1-3-9-5-7-10(4-2)8-6-9;1-2-4-5-3-1/h3,5-8H,1,4H2,2H3;5H,1-4H2
InChIKeyHHUQLMMDYJKITK-UHFFFAOYSA-N
XLogP3.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-ethenyl-4-ethylbenzene;pyrrolidine 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-ethenyl-4-ethylbenzene;pyrrolidine?
The IUPAC name of 1-ethenyl-4-ethylbenzene;pyrrolidine (CID 174791153) is 1-ethenyl-4-ethylbenzene;pyrrolidine.
What is the SMILES notation for 1-ethenyl-4-ethylbenzene;pyrrolidine?
The canonical SMILES for 1-ethenyl-4-ethylbenzene;pyrrolidine is C1CCNC1.C=Cc1ccc(CC)cc1.
What is the InChIKey of 1-ethenyl-4-ethylbenzene;pyrrolidine?
The InChIKey is HHUQLMMDYJKITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12.C4H9N/c1-3-9-5-7-10(4-2)8-6-9;1-2-4-5-3-1/h3,5-8H,1,4H2,2H3;5H,1-4H2.
What are the key properties of 1-ethenyl-4-ethylbenzene;pyrrolidine?
1-ethenyl-4-ethylbenzene;pyrrolidine has a molecular weight of 203.33 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-ethylbenzene;pyrrolidine is sourced from PubChem (CID 174791153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).