5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole

C15H14N2OS — CID 155914367

IUPAC5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole
SMILESCOc1nc2ccccc2cc1-c1sc(C)nc1C
InChIInChI=1S/C15H14N2OS/c1-9-14(19-10(2)16-9)12-8-11-6-4-5-7-13(11)17-15(12)18-3/h4-8H,1-3H3
InChIKeyNZPSWRIHVKULRY-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.98
Rot. Bonds2

About 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole

5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole (PubChem CID 155914367) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole
PubChem CID155914367
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole
SMILESCOc1nc2ccccc2cc1-c1sc(C)nc1C
InChIInChI=1S/C15H14N2OS/c1-9-14(19-10(2)16-9)12-8-11-6-4-5-7-13(11)17-15(12)18-3/h4-8H,1-3H3
InChIKeyNZPSWRIHVKULRY-UHFFFAOYSA-N
XLogP3.98
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole (CID 155914367) is 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole is COc1nc2ccccc2cc1-c1sc(C)nc1C.
What is the InChIKey of 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole?
The InChIKey is NZPSWRIHVKULRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-9-14(19-10(2)16-9)12-8-11-6-4-5-7-13(11)17-15(12)18-3/h4-8H,1-3H3.
What are the key properties of 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole?
5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole has a molecular weight of 270.36 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyquinolin-3-yl)-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 155914367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).