(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone

C13H20N2O3 — CID 3245328

IUPAC(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
SMILESCCc1noc(C)c1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C13H20N2O3/c1-5-11-12(10(4)18-14-11)13(16)15-6-8(2)17-9(3)7-15/h8-9H,5-7H2,1-4H3
InChIKeyOLTXCBRPGJPYGX-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.79
Rot. Bonds2

About (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone

(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone (PubChem CID 3245328) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
PubChem CID3245328
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
SMILESCCc1noc(C)c1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C13H20N2O3/c1-5-11-12(10(4)18-14-11)13(16)15-6-8(2)17-9(3)7-15/h8-9H,5-7H2,1-4H3
InChIKeyOLTXCBRPGJPYGX-UHFFFAOYSA-N
XLogP1.79
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-Ethyl-5-methylisoxazol-4-yl)(morpholino)methanone
CID 1245299
3,5-dimethyl-N-[1-(tetrahydro-2-furanyl)ethyl]-4-isoxazolecarboxamide
CID 2970406
(3,5-Dimethyl-1,2-oxazol-4-yl)-[2-(2-methylpropyl)-2,9-diazaspiro[5.5]undecan-9-yl]methanone
CID 3234303
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-ethyl-N-(2-methoxyethyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 25162068
N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl]-3-ethyl-N-(2-methoxyethyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 24816709
N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-3-ethyl-N-(2-methoxyethyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 25161893
(3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone
CID 1245980
8-[(3,5-Dimethyl-4-isoxazolyl)carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
CID 1245987
N-(2-(Dimethylamino)ethyl)-3-ethyl-5-methylisoxazole-4-carboxamide
CID 1245014
(3,5-Dimethyl-4-isoxazolyl)(morpholino)methanone
CID 2741522
(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-(2-methylpropyl)-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 3233198
(3,5-Dimethyl-4-isoxazolyl)(2,6-dimethylmorpholino)methanone
CID 3751691

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone (CID 3245328) is (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone is CCc1noc(C)c1C(=O)N1CC(C)OC(C)C1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The InChIKey is OLTXCBRPGJPYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-5-11-12(10(4)18-14-11)13(16)15-6-8(2)17-9(3)7-15/h8-9H,5-7H2,1-4H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
(2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone has a molecular weight of 252.31 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone is sourced from PubChem (CID 3245328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).