9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene

C15H26N2 — CID 10977394

IUPAC9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene
SMILESCCCc1c2nc(n1CCC)CCCCCC2
InChIInChI=1S/C15H26N2/c1-3-9-14-13-10-7-5-6-8-11-15(16-13)17(14)12-4-2/h3-12H2,1-2H3
InChIKeyKWMIVSCTNSWIAT-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.90
Rot. Bonds4

About 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene

9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene (PubChem CID 10977394) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene.

Molecular Properties

Compound Name9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene
PubChem CID10977394
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene
SMILESCCCc1c2nc(n1CCC)CCCCCC2
InChIInChI=1S/C15H26N2/c1-3-9-14-13-10-7-5-6-8-11-15(16-13)17(14)12-4-2/h3-12H2,1-2H3
InChIKeyKWMIVSCTNSWIAT-UHFFFAOYSA-N
XLogP3.90
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene 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 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene?
The IUPAC name of 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene (CID 10977394) is 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene.
What is the SMILES notation for 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene?
The canonical SMILES for 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene is CCCc1c2nc(n1CCC)CCCCCC2.
What is the InChIKey of 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene?
The InChIKey is KWMIVSCTNSWIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-3-9-14-13-10-7-5-6-8-11-15(16-13)17(14)12-4-2/h3-12H2,1-2H3.
What are the key properties of 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene?
9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene has a molecular weight of 234.39 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dipropyl-9,11-diazabicyclo[6.2.1]undeca-1(10),8(11)-diene is sourced from PubChem (CID 10977394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).