5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene

C15H20N2 — CID 90117454

IUPAC5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene
SMILESCC1=CC=C2C3=CC=C(C)CN3CCCN2C1
InChIInChI=1S/C15H20N2/c1-12-4-6-14-15-7-5-13(2)11-17(15)9-3-8-16(14)10-12/h4-7H,3,8-11H2,1-2H3
InChIKeyTYLQYPKZSIBNSR-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.68
Rot. Bonds

About 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene

5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene (PubChem CID 90117454) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene.

Molecular Properties

Compound Name5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene
PubChem CID90117454
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene
SMILESCC1=CC=C2C3=CC=C(C)CN3CCCN2C1
InChIInChI=1S/C15H20N2/c1-12-4-6-14-15-7-5-13(2)11-17(15)9-3-8-16(14)10-12/h4-7H,3,8-11H2,1-2H3
InChIKeyTYLQYPKZSIBNSR-UHFFFAOYSA-N
XLogP2.68
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene 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 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene?
The IUPAC name of 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene (CID 90117454) is 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene.
What is the SMILES notation for 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene?
The canonical SMILES for 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene is CC1=CC=C2C3=CC=C(C)CN3CCCN2C1.
What is the InChIKey of 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene?
The InChIKey is TYLQYPKZSIBNSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-12-4-6-14-15-7-5-13(2)11-17(15)9-3-8-16(14)10-12/h4-7H,3,8-11H2,1-2H3.
What are the key properties of 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene?
5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene has a molecular weight of 228.34 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,13-dimethyl-7,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,13-tetraene is sourced from PubChem (CID 90117454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).