N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine

C20H19N3S — CID 7066912

IUPACN-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1cccc(C)c1Nc1c(-c2ccccc2)nc2sccn12
InChIInChI=1S/C20H19N3S/c1-3-15-11-7-8-14(2)17(15)21-19-18(16-9-5-4-6-10-16)22-20-23(19)12-13-24-20/h4-13,21H,3H2,1-2H3
InChIKeyVATXLHDWXLFARS-UHFFFAOYSA-N
MW333.46 g/mol
LogP5.68
Rot. Bonds4

About N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine

N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 7066912) has the molecular formula C20H19N3S and a molecular weight of 333.46 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID7066912
Molecular FormulaC20H19N3S
Molecular Weight333.46 g/mol
Exact Mass333.13
IUPAC NameN-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1cccc(C)c1Nc1c(-c2ccccc2)nc2sccn12
InChIInChI=1S/C20H19N3S/c1-3-15-11-7-8-14(2)17(15)21-19-18(16-9-5-4-6-10-16)22-20-23(19)12-13-24-20/h4-13,21H,3H2,1-2H3
InChIKeyVATXLHDWXLFARS-UHFFFAOYSA-N
XLogP5.68
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.46
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine (CID 7066912) is N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine is CCc1cccc(C)c1Nc1c(-c2ccccc2)nc2sccn12.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is VATXLHDWXLFARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3S/c1-3-15-11-7-8-14(2)17(15)21-19-18(16-9-5-4-6-10-16)22-20-23(19)12-13-24-20/h4-13,21H,3H2,1-2H3.
What are the key properties of N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 333.46 g/mol, XLogP of 5.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-6-phenylimidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 7066912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).