6-fluoro-1,2-dimethylthieno[2,3-d]imidazole

C7H7FN2S — CID 164760725

IUPAC6-fluoro-1,2-dimethylthieno[2,3-d]imidazole
SMILESCc1nc2scc(F)c2n1C
InChIInChI=1S/C7H7FN2S/c1-4-9-7-6(10(4)2)5(8)3-11-7/h3H,1-2H3
InChIKeyPXCDIJYFNFRFRM-UHFFFAOYSA-N
MW170.21 g/mol
LogP2.08
Rot. Bonds

About 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole

6-fluoro-1,2-dimethylthieno[2,3-d]imidazole (PubChem CID 164760725) has the molecular formula C7H7FN2S and a molecular weight of 170.21 g/mol. Its IUPAC name is 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole.

Molecular Properties

Compound Name6-fluoro-1,2-dimethylthieno[2,3-d]imidazole
PubChem CID164760725
Molecular FormulaC7H7FN2S
Molecular Weight170.21 g/mol
Exact Mass170.03
IUPAC Name6-fluoro-1,2-dimethylthieno[2,3-d]imidazole
SMILESCc1nc2scc(F)c2n1C
InChIInChI=1S/C7H7FN2S/c1-4-9-7-6(10(4)2)5(8)3-11-7/h3H,1-2H3
InChIKeyPXCDIJYFNFRFRM-UHFFFAOYSA-N
XLogP2.08
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole?
The IUPAC name of 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole (CID 164760725) is 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole.
What is the SMILES notation for 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole?
The canonical SMILES for 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole is Cc1nc2scc(F)c2n1C.
What is the InChIKey of 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole?
The InChIKey is PXCDIJYFNFRFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2S/c1-4-9-7-6(10(4)2)5(8)3-11-7/h3H,1-2H3.
What are the key properties of 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole?
6-fluoro-1,2-dimethylthieno[2,3-d]imidazole has a molecular weight of 170.21 g/mol, XLogP of 2.08, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1,2-dimethylthieno[2,3-d]imidazole is sourced from PubChem (CID 164760725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).