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6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone

C15H12FN3OS — CID 155092641

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccc(F)cc2[nH]1)N1CCc2ncsc2C1
InChIInChI=1S/C15H12FN3OS/c16-10-2-1-9-5-13(18-12(9)6-10)15(20)19-4-3-11-14(7-19)21-8-17-11/h1-2,5-6,8,18H,3-4,7H2
InChIKeyFUVPGAIKDXUQKI-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.96
Rot. Bonds1

About 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone

6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone (PubChem CID 155092641) has the molecular formula C15H12FN3OS and a molecular weight of 301.35 g/mol. Its IUPAC name is 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone
PubChem CID155092641
Molecular FormulaC15H12FN3OS
Molecular Weight301.35 g/mol
Exact Mass301.07
IUPAC Name6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccc(F)cc2[nH]1)N1CCc2ncsc2C1
InChIInChI=1S/C15H12FN3OS/c16-10-2-1-9-5-13(18-12(9)6-10)15(20)19-4-3-11-14(7-19)21-8-17-11/h1-2,5-6,8,18H,3-4,7H2
InChIKeyFUVPGAIKDXUQKI-UHFFFAOYSA-N
XLogP2.96
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone?
The IUPAC name of 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone (CID 155092641) is 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone.
What is the SMILES notation for 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone?
The canonical SMILES for 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone is O=C(c1cc2ccc(F)cc2[nH]1)N1CCc2ncsc2C1.
What is the InChIKey of 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone?
The InChIKey is FUVPGAIKDXUQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3OS/c16-10-2-1-9-5-13(18-12(9)6-10)15(20)19-4-3-11-14(7-19)21-8-17-11/h1-2,5-6,8,18H,3-4,7H2.
What are the key properties of 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone?
6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone has a molecular weight of 301.35 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl-(6-fluoro-1H-indol-2-yl)methanone is sourced from PubChem (CID 155092641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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