1,3,5,7,9,11,13,15-octazacyclohexadecane

C8H24N8 — CID 118601881

IUPAC1,3,5,7,9,11,13,15-octazacyclohexadecane
SMILESC1NCNCNCNCNCNCNCN1
InChIInChI=1S/C8H24N8/c1-9-2-11-4-13-6-15-8-16-7-14-5-12-3-10-1/h9-16H,1-8H2
InChIKeyHPMAMVMLZIYMRB-UHFFFAOYSA-N
MW232.34 g/mol
LogP-3.62
Rot. Bonds

About 1,3,5,7,9,11,13,15-octazacyclohexadecane

1,3,5,7,9,11,13,15-octazacyclohexadecane (PubChem CID 118601881) has the molecular formula C8H24N8 and a molecular weight of 232.34 g/mol. Its IUPAC name is 1,3,5,7,9,11,13,15-octazacyclohexadecane.

Molecular Properties

Compound Name1,3,5,7,9,11,13,15-octazacyclohexadecane
PubChem CID118601881
Molecular FormulaC8H24N8
Molecular Weight232.34 g/mol
Exact Mass232.21
IUPAC Name1,3,5,7,9,11,13,15-octazacyclohexadecane
SMILESC1NCNCNCNCNCNCNCN1
InChIInChI=1S/C8H24N8/c1-9-2-11-4-13-6-15-8-16-7-14-5-12-3-10-1/h9-16H,1-8H2
InChIKeyHPMAMVMLZIYMRB-UHFFFAOYSA-N
XLogP-3.62
TPSA96.24 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500232.34
LogP ≤ 5-3.62
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

Analyze 1,3,5,7,9,11,13,15-octazacyclohexadecane 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

1,3,5-triazepane
CID 22147931
imidazolidine;hydrofluoride
CID 69023046
CID 86609985
CID 86609985
1,3,5,8,12-pentazacyclotetradecane
CID 15757242
methane;1,3,5,7-triazaphosphocane
CID 87611228
potassium;1,3,5-triazinane;acetate
CID 162319919
1,3,5,7-tetrazabicyclo[3.3.1]nonane;1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane;1,3,5-triazinane
CID 160725872
benzene;imidazolidine
CID 174737453
1,3-diazacyclotridecane
CID 67161330
imidazolidine;methanol
CID 160892789
tris(prop-2-enoic acid);1,3,5-triazinane
CID 174985722
azane;1,3,6,10-tetrazacyclododecane
CID 174902715

Frequently Asked Questions

What is the IUPAC name of 1,3,5,7,9,11,13,15-octazacyclohexadecane?
The IUPAC name of 1,3,5,7,9,11,13,15-octazacyclohexadecane (CID 118601881) is 1,3,5,7,9,11,13,15-octazacyclohexadecane.
What is the SMILES notation for 1,3,5,7,9,11,13,15-octazacyclohexadecane?
The canonical SMILES for 1,3,5,7,9,11,13,15-octazacyclohexadecane is C1NCNCNCNCNCNCNCN1.
What is the InChIKey of 1,3,5,7,9,11,13,15-octazacyclohexadecane?
The InChIKey is HPMAMVMLZIYMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H24N8/c1-9-2-11-4-13-6-15-8-16-7-14-5-12-3-10-1/h9-16H,1-8H2.
What are the key properties of 1,3,5,7,9,11,13,15-octazacyclohexadecane?
1,3,5,7,9,11,13,15-octazacyclohexadecane has a molecular weight of 232.34 g/mol, XLogP of -3.62, 0 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,7,9,11,13,15-octazacyclohexadecane is sourced from PubChem (CID 118601881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).