6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine

C10H11N3S — CID 66354556

IUPAC6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine
SMILESNNc1c2c(nc3ccsc13)CCC2
InChIInChI=1S/C10H11N3S/c11-13-9-6-2-1-3-7(6)12-8-4-5-14-10(8)9/h4-5H,1-3,11H2,(H,12,13)
InChIKeyBGQGAYAVRUOHDN-UHFFFAOYSA-N
MW205.29 g/mol
LogP2.07
Rot. Bonds1

About 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine

6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine (PubChem CID 66354556) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine.

Molecular Properties

Compound Name6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine
PubChem CID66354556
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine
SMILESNNc1c2c(nc3ccsc13)CCC2
InChIInChI=1S/C10H11N3S/c11-13-9-6-2-1-3-7(6)12-8-4-5-14-10(8)9/h4-5H,1-3,11H2,(H,12,13)
InChIKeyBGQGAYAVRUOHDN-UHFFFAOYSA-N
XLogP2.07
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine with MolForge

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Related Compounds

5-Phenylthieno[3,2-b]pyridine
CID 24747710
5,7-Dimethylthieno [3,2-b]-pyridine
CID 86180634
6-Ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine
CID 71046228
5,6,7,8-Tetrahydrothieno[3,2-b]quinolin-9-amine
CID 15385074
5-(4-methylphenyl)-N-phenylthieno[3,2-b]pyridin-7-amine
CID 15418458
3-Amino-6,7-dihydro-5h-cyclopenta[b]thieno[3,2-e]pyridine
CID 155292848
[5-(Trifluoromethyl)thieno[3,2-b]pyridin-7-yl]hydrazine
CID 66353716
N-ethyl-6-methyl-5-(trifluoromethyl)thieno[3,2-b]pyridin-7-amine
CID 66354132
[6-Methyl-5-(trifluoromethyl)thieno[3,2-b]pyridin-7-yl]hydrazine
CID 66354138
[5-(Difluoromethyl)thieno[3,2-b]pyridin-7-yl]hydrazine
CID 66354345
6-methyl-N-propyl-5-(trifluoromethyl)thieno[3,2-b]pyridin-7-amine
CID 66355406
6-Methyl-5-(trifluoromethyl)thieno[3,2-b]pyridin-7-amine
CID 66356037

Frequently Asked Questions

What is the IUPAC name of 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine?
The IUPAC name of 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine (CID 66354556) is 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine.
What is the SMILES notation for 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine?
The canonical SMILES for 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine is NNc1c2c(nc3ccsc13)CCC2.
What is the InChIKey of 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine?
The InChIKey is BGQGAYAVRUOHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c11-13-9-6-2-1-3-7(6)12-8-4-5-14-10(8)9/h4-5H,1-3,11H2,(H,12,13).
What are the key properties of 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine?
6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine has a molecular weight of 205.29 g/mol, XLogP of 2.07, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8-tetraen-8-ylhydrazine is sourced from PubChem (CID 66354556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).