(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone

C18H18N4O3S — CID 97345291

IUPAC(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
SMILESCc1nc(C)c(C(=O)N2CCOC[C@H]2c2noc(-c3ccccc3)n2)s1
InChIInChI=1S/C18H18N4O3S/c1-11-15(26-12(2)19-11)18(23)22-8-9-24-10-14(22)16-20-17(25-21-16)13-6-4-3-5-7-13/h3-7,14H,8-10H2,1-2H3/t14-/m0/s1
InChIKeyLKRWNIQMPSONDJ-AWEZNQCLSA-N
MW370.43 g/mol
LogP3.02
Rot. Bonds3

About (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone

(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone (PubChem CID 97345291) has the molecular formula C18H18N4O3S and a molecular weight of 370.43 g/mol. Its IUPAC name is (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
PubChem CID97345291
Molecular FormulaC18H18N4O3S
Molecular Weight370.43 g/mol
Exact Mass370.11
IUPAC Name(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
SMILESCc1nc(C)c(C(=O)N2CCOC[C@H]2c2noc(-c3ccccc3)n2)s1
InChIInChI=1S/C18H18N4O3S/c1-11-15(26-12(2)19-11)18(23)22-8-9-24-10-14(22)16-20-17(25-21-16)13-6-4-3-5-7-13/h3-7,14H,8-10H2,1-2H3/t14-/m0/s1
InChIKeyLKRWNIQMPSONDJ-AWEZNQCLSA-N
XLogP3.02
TPSA81.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(2-ethyl-1,3-thiazol-5-yl)-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 75474979
morpholin-4-yl-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 97344845
(2-hydroxy-5-methoxyphenyl)-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 75474993
[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone
CID 75474989
4-[(3R)-4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)morpholin-3-yl]-2-methyl-1H-pyrimidin-6-one
CID 137149613
[1-(2-methylpropyl)piperidin-4-yl]-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 75474998
4-hydroxy-6-methyl-1-[2-oxo-2-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethyl]pyridin-2-one
CID 136521699
(3-methylmorpholin-4-yl)-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone
CID 110309752
3-(furan-2-yl)-1-[3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]prop-2-en-1-one
CID 126773272
4-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)morpholine-3-carboxylic acid
CID 119215888
(3R)-4-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)morpholine-3-carboxylic acid
CID 125150119
[(3R)-3-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]morpholin-4-yl]-naphthalen-1-ylmethanone
CID 97345988

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone?
The IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone (CID 97345291) is (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone?
The canonical SMILES for (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone is Cc1nc(C)c(C(=O)N2CCOC[C@H]2c2noc(-c3ccccc3)n2)s1.
What is the InChIKey of (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone?
The InChIKey is LKRWNIQMPSONDJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H18N4O3S/c1-11-15(26-12(2)19-11)18(23)22-8-9-24-10-14(22)16-20-17(25-21-16)13-6-4-3-5-7-13/h3-7,14H,8-10H2,1-2H3/t14-/m0/s1.
What are the key properties of (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone?
(2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone has a molecular weight of 370.43 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethyl-1,3-thiazol-5-yl)-[(3R)-3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 97345291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).