2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone

C20H18N4OS — CID 11302942

IUPAC2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone
SMILESCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2snnc2C)cc1
InChIInChI=1S/C20H18N4OS/c1-12-4-7-15(8-5-12)19-16(10-17(25)20-14(3)22-23-26-20)24-11-13(2)6-9-18(24)21-19/h4-9,11H,10H2,1-3H3
InChIKeyDDSQLAZNSYYIAD-UHFFFAOYSA-N
MW362.46 g/mol
LogP4.20
Rot. Bonds4

About 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone

2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone (PubChem CID 11302942) has the molecular formula C20H18N4OS and a molecular weight of 362.46 g/mol. Its IUPAC name is 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone.

Molecular Properties

Compound Name2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone
PubChem CID11302942
Molecular FormulaC20H18N4OS
Molecular Weight362.46 g/mol
Exact Mass362.12
IUPAC Name2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone
SMILESCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2snnc2C)cc1
InChIInChI=1S/C20H18N4OS/c1-12-4-7-15(8-5-12)19-16(10-17(25)20-14(3)22-23-26-20)24-11-13(2)6-9-18(24)21-19/h4-9,11H,10H2,1-3H3
InChIKeyDDSQLAZNSYYIAD-UHFFFAOYSA-N
XLogP4.20
TPSA60.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone?
The IUPAC name of 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone (CID 11302942) is 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone.
What is the SMILES notation for 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone?
The canonical SMILES for 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone is Cc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2snnc2C)cc1.
What is the InChIKey of 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone?
The InChIKey is DDSQLAZNSYYIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4OS/c1-12-4-7-15(8-5-12)19-16(10-17(25)20-14(3)22-23-26-20)24-11-13(2)6-9-18(24)21-19/h4-9,11H,10H2,1-3H3.
What are the key properties of 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone?
2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone has a molecular weight of 362.46 g/mol, XLogP of 4.20, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone is sourced from PubChem (CID 11302942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).