7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene

C14H17N3 — CID 14004035

IUPAC7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene
SMILESc1cnc2[nH]c3c(c2c1)CCN1CCCCC31
InChIInChI=1S/C14H17N3/c1-2-8-17-9-6-10-11-4-3-7-15-14(11)16-13(10)12(17)5-1/h3-4,7,12H,1-2,5-6,8-9H2,(H,15,16)
InChIKeyQCUFMOWEXODOQM-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.65
Rot. Bonds

About 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene

7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene (PubChem CID 14004035) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene.

Molecular Properties

Compound Name7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene
PubChem CID14004035
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene
SMILESc1cnc2[nH]c3c(c2c1)CCN1CCCCC31
InChIInChI=1S/C14H17N3/c1-2-8-17-9-6-10-11-4-3-7-15-14(11)16-13(10)12(17)5-1/h3-4,7,12H,1-2,5-6,8-9H2,(H,15,16)
InChIKeyQCUFMOWEXODOQM-UHFFFAOYSA-N
XLogP2.65
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-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 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene?
The IUPAC name of 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene (CID 14004035) is 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene.
What is the SMILES notation for 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene?
The canonical SMILES for 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene is c1cnc2[nH]c3c(c2c1)CCN1CCCCC31.
What is the InChIKey of 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene?
The InChIKey is QCUFMOWEXODOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-2-8-17-9-6-10-11-4-3-7-15-14(11)16-13(10)12(17)5-1/h3-4,7,12H,1-2,5-6,8-9H2,(H,15,16).
What are the key properties of 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene?
7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene has a molecular weight of 227.31 g/mol, XLogP of 2.65, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,15,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),11(16),12,14-tetraene is sourced from PubChem (CID 14004035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).