2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine

C17H19N3S — CID 82068493

IUPAC2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESCc1sc2nc(-c3ccc4c(c3)CCCC4)c(N)n2c1C
InChIInChI=1S/C17H19N3S/c1-10-11(2)21-17-19-15(16(18)20(10)17)14-8-7-12-5-3-4-6-13(12)9-14/h7-9H,3-6,18H2,1-2H3
InChIKeyXWVPVJDDGMJVMD-UHFFFAOYSA-N
MW297.43 g/mol
LogP4.14
Rot. Bonds1

About 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine

2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 82068493) has the molecular formula C17H19N3S and a molecular weight of 297.43 g/mol. Its IUPAC name is 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound Name2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID82068493
Molecular FormulaC17H19N3S
Molecular Weight297.43 g/mol
Exact Mass297.13
IUPAC Name2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESCc1sc2nc(-c3ccc4c(c3)CCCC4)c(N)n2c1C
InChIInChI=1S/C17H19N3S/c1-10-11(2)21-17-19-15(16(18)20(10)17)14-8-7-12-5-3-4-6-13(12)9-14/h7-9H,3-6,18H2,1-2H3
InChIKeyXWVPVJDDGMJVMD-UHFFFAOYSA-N
XLogP4.14
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.43
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine (CID 82068493) is 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine is Cc1sc2nc(-c3ccc4c(c3)CCCC4)c(N)n2c1C.
What is the InChIKey of 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is XWVPVJDDGMJVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3S/c1-10-11(2)21-17-19-15(16(18)20(10)17)14-8-7-12-5-3-4-6-13(12)9-14/h7-9H,3-6,18H2,1-2H3.
What are the key properties of 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine?
2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 297.43 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 82068493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).