7H-thieno[3,2-a]quinolizine

C11H9NS — CID 67258030

IUPAC7H-thieno[3,2-a]quinolizine
SMILESC1=CCN2C=Cc3sccc3C2=C1
InChIInChI=1S/C11H9NS/c1-2-6-12-7-4-11-9(5-8-13-11)10(12)3-1/h1-5,7-8H,6H2
InChIKeyFTQQYGVAJPAJMI-UHFFFAOYSA-N
MW187.27 g/mol
LogP2.95
Rot. Bonds

About 7H-thieno[3,2-a]quinolizine

7H-thieno[3,2-a]quinolizine (PubChem CID 67258030) has the molecular formula C11H9NS and a molecular weight of 187.27 g/mol. Its IUPAC name is 7H-thieno[3,2-a]quinolizine.

Molecular Properties

Compound Name7H-thieno[3,2-a]quinolizine
PubChem CID67258030
Molecular FormulaC11H9NS
Molecular Weight187.27 g/mol
Exact Mass187.05
IUPAC Name7H-thieno[3,2-a]quinolizine
SMILESC1=CCN2C=Cc3sccc3C2=C1
InChIInChI=1S/C11H9NS/c1-2-6-12-7-4-11-9(5-8-13-11)10(12)3-1/h1-5,7-8H,6H2
InChIKeyFTQQYGVAJPAJMI-UHFFFAOYSA-N
XLogP2.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.27
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Dimethylamino)methyl-3-methylthiophene
CID 10080668
6-Methylthieno[2,3-c]pyridine-7-thione
CID 121405862
6-Tert-butyl-4-fluoro-7-methylidenethieno[2,3-c]pyridine
CID 121403786
4-Fluoro-6-methylthieno[2,3-c]pyridine-7-thione
CID 121405858
1,3-dimethyl-6-thiophen-2-yl-4-(trifluoromethyl)-2H-pyridine
CID 123915508
6-Tert-butyl-4-fluorothieno[2,3-c]pyridine-7-thione
CID 126503372
4-Fluoro-6-(2-methylbutan-2-yl)thieno[2,3-c]pyridine-7-thione
CID 146276515
4-fluoro-6-propan-2-yl-7H-thieno[2,3-c]pyridine
CID 154964411
6-tert-butyl-4-fluoro-7H-thieno[2,3-c]pyridine-7-thiol
CID 155177357
4-Fluoro-6-propylthieno[2,3-c]pyridine-7-thione
CID 164967438
6-tert-butyl-4-fluoro-7H-thieno[2,3-c]pyridine
CID 170045621
5,6-Dimethyl-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine
CID 57423980

Frequently Asked Questions

What is the IUPAC name of 7H-thieno[3,2-a]quinolizine?
The IUPAC name of 7H-thieno[3,2-a]quinolizine (CID 67258030) is 7H-thieno[3,2-a]quinolizine.
What is the SMILES notation for 7H-thieno[3,2-a]quinolizine?
The canonical SMILES for 7H-thieno[3,2-a]quinolizine is C1=CCN2C=Cc3sccc3C2=C1.
What is the InChIKey of 7H-thieno[3,2-a]quinolizine?
The InChIKey is FTQQYGVAJPAJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NS/c1-2-6-12-7-4-11-9(5-8-13-11)10(12)3-1/h1-5,7-8H,6H2.
What are the key properties of 7H-thieno[3,2-a]quinolizine?
7H-thieno[3,2-a]quinolizine has a molecular weight of 187.27 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-thieno[3,2-a]quinolizine is sourced from PubChem (CID 67258030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).