morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone

C20H19N3O2S — CID 159923241

IUPACmorpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone
SMILESO=C(c1ccc(-c2csc(Cc3ccccn3)n2)cc1)N1CCOCC1
InChIInChI=1S/C20H19N3O2S/c24-20(23-9-11-25-12-10-23)16-6-4-15(5-7-16)18-14-26-19(22-18)13-17-3-1-2-8-21-17/h1-8,14H,9-13H2
InChIKeyNYRKJJQJYMLICG-UHFFFAOYSA-N
MW365.46 g/mol
LogP3.27
Rot. Bonds4

About morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone

morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone (PubChem CID 159923241) has the molecular formula C20H19N3O2S and a molecular weight of 365.46 g/mol. Its IUPAC name is morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone
PubChem CID159923241
Molecular FormulaC20H19N3O2S
Molecular Weight365.46 g/mol
Exact Mass365.12
IUPAC Namemorpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone
SMILESO=C(c1ccc(-c2csc(Cc3ccccn3)n2)cc1)N1CCOCC1
InChIInChI=1S/C20H19N3O2S/c24-20(23-9-11-25-12-10-23)16-6-4-15(5-7-16)18-14-26-19(22-18)13-17-3-1-2-8-21-17/h1-8,14H,9-13H2
InChIKeyNYRKJJQJYMLICG-UHFFFAOYSA-N
XLogP3.27
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-phenyl-2-(pyridin-2-ylmethyl)-1,3-thiazole
CID 31263387
[6-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]-3-pyridinyl]-(1,4-oxazepan-4-yl)methanone
CID 146956911
1-morpholin-4-yl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propan-1-one
CID 110647606
1-[4-[2-(morpholin-4-ylmethyl)-1,3-thiazol-4-yl]phenyl]ethanone
CID 21135766
1-morpholin-4-yl-2-(4-phenyl-1,3-thiazol-2-yl)ethanethione
CID 27439636
1-morpholin-4-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanone
CID 33236750
2-(6-methyl-2-pyridinyl)-1-[2-[4-(morpholine-4-carbonyl)phenyl]-4-pyridinyl]ethanone
CID 58585961
[4-methyl-2-(2-pyridin-2-ylethyl)-1,3-thiazol-5-yl]-morpholin-4-ylmethanone
CID 110389286
oxalic acid;(4-phenylphenyl)-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
CID 17365950
morpholin-4-yl-[4-(2H-tetrazol-5-yl)phenyl]methanone
CID 32686320
morpholin-4-yl-[4-[[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]methoxy]phenyl]methanone
CID 163339790
(4-cyclohexylpiperazin-1-yl)-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]methanone
CID 53037663

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone?
The IUPAC name of morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone (CID 159923241) is morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone?
The canonical SMILES for morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone is O=C(c1ccc(-c2csc(Cc3ccccn3)n2)cc1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone?
The InChIKey is NYRKJJQJYMLICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2S/c24-20(23-9-11-25-12-10-23)16-6-4-15(5-7-16)18-14-26-19(22-18)13-17-3-1-2-8-21-17/h1-8,14H,9-13H2.
What are the key properties of morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone?
morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone has a molecular weight of 365.46 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-[2-(pyridin-2-ylmethyl)-1,3-thiazol-4-yl]phenyl]methanone is sourced from PubChem (CID 159923241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).