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

C19H23N3O2S — CID 1236967

IUPAC(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
SMILESO=C(c1sc(N2CCOCC2)nc1-c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H23N3O2S/c23-18(21-9-5-2-6-10-21)17-16(15-7-3-1-4-8-15)20-19(25-17)22-11-13-24-14-12-22/h1,3-4,7-8H,2,5-6,9-14H2
InChIKeyVUMHUKFLUGQDIF-UHFFFAOYSA-N
MW357.48 g/mol
LogP3.27
Rot. Bonds3

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

(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (PubChem CID 1236967) has the molecular formula C19H23N3O2S and a molecular weight of 357.48 g/mol. Its IUPAC name is (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
PubChem CID1236967
Molecular FormulaC19H23N3O2S
Molecular Weight357.48 g/mol
Exact Mass357.15
IUPAC Name(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
SMILESO=C(c1sc(N2CCOCC2)nc1-c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H23N3O2S/c23-18(21-9-5-2-6-10-21)17-16(15-7-3-1-4-8-15)20-19(25-17)22-11-13-24-14-12-22/h1,3-4,7-8H,2,5-6,9-14H2
InChIKeyVUMHUKFLUGQDIF-UHFFFAOYSA-N
XLogP3.27
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-Lox-IN-1
CID 2354998
4-Benzyl-2-morpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 66780027
2-(Morpholin-4-yl)-4-phenyl-1,3-thiazole-5-carbaldehyde
CID 2326533
N-cyclohexyl-2-(morpholin-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 1236968
(2,4-Diphenylthiazol-5-yl)-[4-(1-piperidyl)-1-piperidyl]methanone
CID 54583640
4-[2-(2,3-Dihydroindol-1-yl)-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 57411134
2-Morpholin-4-yl-4-(1-phenylethyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 70689166
5-Acetyl-2-morpholin-4-yl-4-phenyl-1,3-thiazole
CID 2377052
1-(5-Benzoyl-4-phenyl-1,3-thiazol-2-yl)piperidine
CID 4968501
4-(5-Methyl-4-phenyl-1,3-thiazol-2-yl)morpholine
CID 55355450
4-(4-Methylphenyl)-2-morpholin-4-yl(1,3-thiazol-5-yl) piperidyl ketone
CID 1236963
4-[4-(4-Methylphenyl)-5-(4-morpholinylcarbonyl)-1,3-thiazol-2-yl]morpholine
CID 1236964

Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The IUPAC name of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (CID 1236967) is (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is O=C(c1sc(N2CCOCC2)nc1-c1ccccc1)N1CCCCC1.
What is the InChIKey of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The InChIKey is VUMHUKFLUGQDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S/c23-18(21-9-5-2-6-10-21)17-16(15-7-3-1-4-8-15)20-19(25-17)22-11-13-24-14-12-22/h1,3-4,7-8H,2,5-6,9-14H2.
What are the key properties of (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone has a molecular weight of 357.48 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 1236967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).