11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene

C14H19N — CID 142819225

IUPAC11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene
SMILESCN1CC2CCC1Cc1ccccc1C2
InChIInChI=1S/C14H19N/c1-15-10-11-6-7-14(15)9-13-5-3-2-4-12(13)8-11/h2-5,11,14H,6-10H2,1H3
InChIKeyWEMOLZPFGYHIKO-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.50
Rot. Bonds

About 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene

11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene (PubChem CID 142819225) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene.

Molecular Properties

Compound Name11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene
PubChem CID142819225
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene
SMILESCN1CC2CCC1Cc1ccccc1C2
InChIInChI=1S/C14H19N/c1-15-10-11-6-7-14(15)9-13-5-3-2-4-12(13)8-11/h2-5,11,14H,6-10H2,1H3
InChIKeyWEMOLZPFGYHIKO-UHFFFAOYSA-N
XLogP2.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene?
The IUPAC name of 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene (CID 142819225) is 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene.
What is the SMILES notation for 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene?
The canonical SMILES for 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene is CN1CC2CCC1Cc1ccccc1C2.
What is the InChIKey of 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene?
The InChIKey is WEMOLZPFGYHIKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-15-10-11-6-7-14(15)9-13-5-3-2-4-12(13)8-11/h2-5,11,14H,6-10H2,1H3.
What are the key properties of 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene?
11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene has a molecular weight of 201.31 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-triene is sourced from PubChem (CID 142819225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).