(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone

C18H24N4O3 — CID 71972923

IUPAC(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone
SMILESCCc1nc(CNc2ccc(C(=O)N3CC(C)OC(C)C3)cc2)no1
InChIInChI=1S/C18H24N4O3/c1-4-17-20-16(21-25-17)9-19-15-7-5-14(6-8-15)18(23)22-10-12(2)24-13(3)11-22/h5-8,12-13,19H,4,9-11H2,1-3H3
InChIKeyINDRKTQWFLRUNI-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.49
Rot. Bonds5

About (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone

(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone (PubChem CID 71972923) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone
PubChem CID71972923
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone
SMILESCCc1nc(CNc2ccc(C(=O)N3CC(C)OC(C)C3)cc2)no1
InChIInChI=1S/C18H24N4O3/c1-4-17-20-16(21-25-17)9-19-15-7-5-14(6-8-15)18(23)22-10-12(2)24-13(3)11-22/h5-8,12-13,19H,4,9-11H2,1-3H3
InChIKeyINDRKTQWFLRUNI-UHFFFAOYSA-N
XLogP2.49
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone with MolForge

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Related Compounds

(2,6-dimethylmorpholin-4-yl)-[4-(ethylamino)phenyl]methanone
CID 62170652
(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
CID 62170653
4-[[4-(2,6-dimethylmorpholine-4-carbonyl)anilino]methyl]benzoic acid
CID 122033835
[4-[(2-chloro-1,3-thiazol-5-yl)methylamino]phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 168582257
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
methyl 2-[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]anilino]acetate
CID 94631757
3-[[4-(2,6-dimethylmorpholine-4-carbonyl)anilino]methyl]benzoic acid
CID 122033836
1-(azocan-1-yl)-2-[4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]anilino]ethanone
CID 94631749
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[4-[2-[(2S)-oxolan-2-yl]ethylamino]phenyl]methanone
CID 99828580
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
CID 42915501
(2,6-dimethylmorpholin-4-yl)-[6-(ethylamino)-3-pyridinyl]methanone
CID 62171862
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[6-(ethylamino)-3-pyridinyl]methanone
CID 104960451

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone (CID 71972923) is (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone is CCc1nc(CNc2ccc(C(=O)N3CC(C)OC(C)C3)cc2)no1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone?
The InChIKey is INDRKTQWFLRUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-4-17-20-16(21-25-17)9-19-15-7-5-14(6-8-15)18(23)22-10-12(2)24-13(3)11-22/h5-8,12-13,19H,4,9-11H2,1-3H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone?
(2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone has a molecular weight of 344.42 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]methanone is sourced from PubChem (CID 71972923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).