2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone

C18H20N2O3S — CID 75426196

IUPAC2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone
SMILESCCc1ncc(C(=O)N2CCOCC2CC(=O)c2ccccc2)s1
InChIInChI=1S/C18H20N2O3S/c1-2-17-19-11-16(24-17)18(22)20-8-9-23-12-14(20)10-15(21)13-6-4-3-5-7-13/h3-7,11,14H,2,8-10,12H2,1H3
InChIKeyWZODAFZHFLUOHS-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.82
Rot. Bonds5

About 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone

2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone (PubChem CID 75426196) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone.

Molecular Properties

Compound Name2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone
PubChem CID75426196
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC Name2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone
SMILESCCc1ncc(C(=O)N2CCOCC2CC(=O)c2ccccc2)s1
InChIInChI=1S/C18H20N2O3S/c1-2-17-19-11-16(24-17)18(22)20-8-9-23-12-14(20)10-15(21)13-6-4-3-5-7-13/h3-7,11,14H,2,8-10,12H2,1H3
InChIKeyWZODAFZHFLUOHS-UHFFFAOYSA-N
XLogP2.82
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-ethyl-1,3-thiazol-5-yl)-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 75474979
1-(4-methylphenyl)-4-[(3S)-3-phenacylmorpholin-4-yl]butane-1,4-dione
CID 97320578
(3S)-4-(2-propyl-1,3-thiazole-5-carbonyl)morpholine-3-carboxylic acid
CID 125119497
1-phenyl-2-[(3S)-4-(2-thiophen-2-ylacetyl)morpholin-3-yl]ethanone
CID 97320577
1-(furan-2-yl)-2-[(3S)-4-(2-propan-2-yl-1,3-thiazole-5-carbonyl)morpholin-3-yl]ethanone
CID 97244050
2-[4-[2-(2-tert-butyl-1,3-thiazol-4-yl)acetyl]morpholin-3-yl]-1-phenylethanone
CID 75426197
1-phenyl-2-[4-(1,3-thiazol-2-ylmethyl)morpholin-3-yl]ethanone
CID 86796786
1-(3-phenacylmorpholin-4-yl)-2-pyrazol-1-ylpropan-1-one
CID 75426175
(2S)-1-[(3R)-3-phenacylmorpholin-4-yl]-2-pyrazol-1-ylpropan-1-one
CID 97320552
3-(5-methylfuran-2-yl)-1-[(3S)-3-phenacylmorpholin-4-yl]propan-1-one
CID 97320572
2-[(3R)-4-[(1R,2R)-2-(furan-2-yl)cyclopropanecarbonyl]morpholin-3-yl]-1-phenylethanone
CID 124740066
[(3R)-3-(hydroxymethyl)morpholin-4-yl]-phenylmethanone;hydrochloride
CID 118953500

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone?
The IUPAC name of 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone (CID 75426196) is 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone.
What is the SMILES notation for 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone?
The canonical SMILES for 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone is CCc1ncc(C(=O)N2CCOCC2CC(=O)c2ccccc2)s1.
What is the InChIKey of 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone?
The InChIKey is WZODAFZHFLUOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-2-17-19-11-16(24-17)18(22)20-8-9-23-12-14(20)10-15(21)13-6-4-3-5-7-13/h3-7,11,14H,2,8-10,12H2,1H3.
What are the key properties of 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone?
2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone has a molecular weight of 344.44 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-ethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-1-phenylethanone is sourced from PubChem (CID 75426196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).