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

C15H16N2O2S — CID 2377052

IUPAC1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone
SMILESCC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C15H16N2O2S/c1-11(18)14-13(12-5-3-2-4-6-12)16-15(20-14)17-7-9-19-10-8-17/h2-6H,7-10H2,1H3
InChIKeyMSNXHNITBGTMMC-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.85
Rot. Bonds3

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

1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone (PubChem CID 2377052) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone.

Molecular Properties

Compound Name1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone
PubChem CID2377052
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone
SMILESCC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C15H16N2O2S/c1-11(18)14-13(12-5-3-2-4-6-12)16-15(20-14)17-7-9-19-10-8-17/h2-6H,7-10H2,1H3
InChIKeyMSNXHNITBGTMMC-UHFFFAOYSA-N
XLogP2.85
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone?
The IUPAC name of 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone (CID 2377052) is 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone.
What is the SMILES notation for 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone?
The canonical SMILES for 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone is CC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1.
What is the InChIKey of 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone?
The InChIKey is MSNXHNITBGTMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-11(18)14-13(12-5-3-2-4-6-12)16-15(20-14)17-7-9-19-10-8-17/h2-6H,7-10H2,1H3.
What are the key properties of 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone?
1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone has a molecular weight of 288.37 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)ethanone is sourced from PubChem (CID 2377052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).