4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene

C15H21N3 — CID 73388555

IUPAC4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene
SMILESCC1CNCc2cccc3c2N1CCN3C1CC1
InChIInChI=1S/C15H21N3/c1-11-9-16-10-12-3-2-4-14-15(12)17(11)7-8-18(14)13-5-6-13/h2-4,11,13,16H,5-10H2,1H3
InChIKeyFSLBPXRRUVVFTG-UHFFFAOYSA-N
MW243.35 g/mol
LogP1.97
Rot. Bonds1

About 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene

4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene (PubChem CID 73388555) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene.

Molecular Properties

Compound Name4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene
PubChem CID73388555
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene
SMILESCC1CNCc2cccc3c2N1CCN3C1CC1
InChIInChI=1S/C15H21N3/c1-11-9-16-10-12-3-2-4-14-15(12)17(11)7-8-18(14)13-5-6-13/h2-4,11,13,16H,5-10H2,1H3
InChIKeyFSLBPXRRUVVFTG-UHFFFAOYSA-N
XLogP1.97
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene 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 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene?
The IUPAC name of 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene (CID 73388555) is 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene.
What is the SMILES notation for 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene?
The canonical SMILES for 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene is CC1CNCc2cccc3c2N1CCN3C1CC1.
What is the InChIKey of 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene?
The InChIKey is FSLBPXRRUVVFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-11-9-16-10-12-3-2-4-14-15(12)17(11)7-8-18(14)13-5-6-13/h2-4,11,13,16H,5-10H2,1H3.
What are the key properties of 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene?
4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene has a molecular weight of 243.35 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-13-methyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene is sourced from PubChem (CID 73388555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).