(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone

C15H16N2O2S — CID 23968873

IUPAC(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone
SMILESCc1nc(-c2ccccc2)sc1C(=O)N1CCOCC1
InChIInChI=1S/C15H16N2O2S/c1-11-13(15(18)17-7-9-19-10-8-17)20-14(16-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
InChIKeyJLBMVGMULMUXNW-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.59
Rot. Bonds2

About (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone

(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone (PubChem CID 23968873) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone
PubChem CID23968873
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone
SMILESCc1nc(-c2ccccc2)sc1C(=O)N1CCOCC1
InChIInChI=1S/C15H16N2O2S/c1-11-13(15(18)17-7-9-19-10-8-17)20-14(16-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
InChIKeyJLBMVGMULMUXNW-UHFFFAOYSA-N
XLogP2.59
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone?
The IUPAC name of (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone (CID 23968873) is (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone is Cc1nc(-c2ccccc2)sc1C(=O)N1CCOCC1.
What is the InChIKey of (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone?
The InChIKey is JLBMVGMULMUXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-11-13(15(18)17-7-9-19-10-8-17)20-14(16-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3.
What are the key properties of (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone?
(4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone has a molecular weight of 288.37 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-phenyl-1,3-thiazol-5-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 23968873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).