2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene

C10H12N2 — CID 15156626

IUPAC2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene
SMILESC1Cc2nc3c(nc2C1)CCC3
InChIInChI=1S/C10H12N2/c1-3-7-8(4-1)12-10-6-2-5-9(10)11-7/h1-6H2
InChIKeyISGZKEZFGDEYSB-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.45
Rot. Bonds

About 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene

2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene (PubChem CID 15156626) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene.

Molecular Properties

Compound Name2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene
PubChem CID15156626
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene
SMILESC1Cc2nc3c(nc2C1)CCC3
InChIInChI=1S/C10H12N2/c1-3-7-8(4-1)12-10-6-2-5-9(10)11-7/h1-6H2
InChIKeyISGZKEZFGDEYSB-UHFFFAOYSA-N
XLogP1.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene 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

2-(6,7-dihydro-5H-cyclopenta[e][1,2,4]triazin-3-yl)ethanol
CID 105432686
7,8-dimethyl-1,2,3,4-tetrahydrophenazine
CID 2813351
5,6-dihydro-4H-cyclopenta[d][1,3]oxazol-2-amine
CID 55252887
2-oxido-15-aza-2-azoniatricyclo[12.12.0.03,16]hexacosa-1,3(16),14-triene
CID 177414686
1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine
CID 39101052
9-amino-1,2,3,5,6,7-hexahydrocyclopenta[b]quinolin-8-one
CID 54430631
2-(6,7-dihydro-5H-cyclopenta[b]pyrazin-3-yl)ethanamine
CID 82415071
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)formamide
CID 64991335
2-methyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoxaline
CID 129153906
2,3-dimethyl-5,6-dihydro-4H-cyclopenta[d]imidazole
CID 59430883
2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 15012906
6-methyl-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,7-trien-8-amine
CID 146617893

Frequently Asked Questions

What is the IUPAC name of 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene?
The IUPAC name of 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene (CID 15156626) is 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene.
What is the SMILES notation for 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene?
The canonical SMILES for 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene is C1Cc2nc3c(nc2C1)CCC3.
What is the InChIKey of 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene?
The InChIKey is ISGZKEZFGDEYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-3-7-8(4-1)12-10-6-2-5-9(10)11-7/h1-6H2.
What are the key properties of 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene?
2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene has a molecular weight of 160.22 g/mol, XLogP of 1.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene is sourced from PubChem (CID 15156626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).