1,4,7,10-tetrazabicyclo[5.5.3]pentadecane

C11H24N4 — CID 15800439

IUPAC1,4,7,10-tetrazabicyclo[5.5.3]pentadecane
SMILESC1CN2CCNCCN(C1)CCNCC2
InChIInChI=1S/C11H24N4/c1-6-14-8-2-12-3-9-15(7-1)11-5-13-4-10-14/h12-13H,1-11H2
InChIKeyZUGNPBCBDYZMGQ-UHFFFAOYSA-N
MW212.34 g/mol
LogP-0.81
Rot. Bonds

About 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane

1,4,7,10-tetrazabicyclo[5.5.3]pentadecane (PubChem CID 15800439) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane.

Molecular Properties

Compound Name1,4,7,10-tetrazabicyclo[5.5.3]pentadecane
PubChem CID15800439
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name1,4,7,10-tetrazabicyclo[5.5.3]pentadecane
SMILESC1CN2CCNCCN(C1)CCNCC2
InChIInChI=1S/C11H24N4/c1-6-14-8-2-12-3-9-15(7-1)11-5-13-4-10-14/h12-13H,1-11H2
InChIKeyZUGNPBCBDYZMGQ-UHFFFAOYSA-N
XLogP-0.81
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

manganese(2+);1,4,8,11-tetrazabicyclo[6.6.2]hexadecane
CID 159257789
1,4,8,11-tetrazabicyclo[9.5.2]octadecane
CID 6396556
7-methyl-1,4,7,10,13-pentazabicyclo[11.2.2]heptadecane
CID 58730173
1,4,7,9,11,14,19-heptazatricyclo[7.7.4.24,14]docosane
CID 102300822
2-(1,4,8,11-tetrazabicyclo[6.6.2]hexadecan-4-yl)acetaldehyde
CID 165084885
5-[[4-(1,5,8,13-tetrazabicyclo[11.2.2]heptadecan-5-ylmethyl)phenyl]methyl]-1,5,8,13-tetrazabicyclo[11.2.2]heptadecane
CID 158835050
cyclooctane;1,7-diazabicyclo[5.5.3]pentadecane;methane
CID 162186921
cyclopropane;1-methylpiperazine
CID 166166790
1-(azetidin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 130547937
1,4-diazabicyclo[4.2.2]decane
CID 19908218
1,8,11,14,21,24,29,36-octazapentacyclo[19.5.5.58,14.23,6.216,19]tetraconta-3(40),4,6(39),16,18,32-hexaene
CID 10697879
copper(1+);1,4-diazabicyclo[2.2.2]octane
CID 10192600

Frequently Asked Questions

What is the IUPAC name of 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane?
The IUPAC name of 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane (CID 15800439) is 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane.
What is the SMILES notation for 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane?
The canonical SMILES for 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane is C1CN2CCNCCN(C1)CCNCC2.
What is the InChIKey of 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane?
The InChIKey is ZUGNPBCBDYZMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-6-14-8-2-12-3-9-15(7-1)11-5-13-4-10-14/h12-13H,1-11H2.
What are the key properties of 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane?
1,4,7,10-tetrazabicyclo[5.5.3]pentadecane has a molecular weight of 212.34 g/mol, XLogP of -0.81, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,7,10-tetrazabicyclo[5.5.3]pentadecane is sourced from PubChem (CID 15800439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).