(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone

C13H10N2OS — CID 5202631

IUPAC(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone
SMILESCc1nc2sccn2c1C(=O)c1ccccc1
InChIInChI=1S/C13H10N2OS/c1-9-11(15-7-8-17-13(15)14-9)12(16)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyJFWLGWOCQIWZSL-UHFFFAOYSA-N
MW242.30 g/mol
LogP2.94
Rot. Bonds2

About (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone

(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone (PubChem CID 5202631) has the molecular formula C13H10N2OS and a molecular weight of 242.30 g/mol. Its IUPAC name is (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone.

Molecular Properties

Compound Name(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone
PubChem CID5202631
Molecular FormulaC13H10N2OS
Molecular Weight242.30 g/mol
Exact Mass242.05
IUPAC Name(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone
SMILESCc1nc2sccn2c1C(=O)c1ccccc1
InChIInChI=1S/C13H10N2OS/c1-9-11(15-7-8-17-13(15)14-9)12(16)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyJFWLGWOCQIWZSL-UHFFFAOYSA-N
XLogP2.94
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone?
The IUPAC name of (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone (CID 5202631) is (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone.
What is the SMILES notation for (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone?
The canonical SMILES for (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone is Cc1nc2sccn2c1C(=O)c1ccccc1.
What is the InChIKey of (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone?
The InChIKey is JFWLGWOCQIWZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2OS/c1-9-11(15-7-8-17-13(15)14-9)12(16)10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone?
(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone has a molecular weight of 242.30 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-phenylmethanone is sourced from PubChem (CID 5202631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).