3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide

C18H23N3O3 — CID 51096940

IUPAC3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)NCc1ccccc1N1CCOCC1
InChIInChI=1S/C18H23N3O3/c1-3-15-17(13(2)24-20-15)18(22)19-12-14-6-4-5-7-16(14)21-8-10-23-11-9-21/h4-7H,3,8-12H2,1-2H3,(H,19,22)
InChIKeyUBCQYGKRHFOGMX-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.31
Rot. Bonds5

About 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide

3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide (PubChem CID 51096940) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide
PubChem CID51096940
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)NCc1ccccc1N1CCOCC1
InChIInChI=1S/C18H23N3O3/c1-3-15-17(13(2)24-20-15)18(22)19-12-14-6-4-5-7-16(14)21-8-10-23-11-9-21/h4-7H,3,8-12H2,1-2H3,(H,19,22)
InChIKeyUBCQYGKRHFOGMX-UHFFFAOYSA-N
XLogP2.31
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 71883592
2-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 47400471
N-(2,6-diethylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 17173863
4-acetamido-N-[(2-morpholin-4-ylphenyl)methyl]benzamide
CID 47788856
4-methyl-3-morpholin-4-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide
CID 46977362
3,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-1,2-oxazole-4-carboxamide
CID 25404526
3-ethyl-5-methyl-N-(thiophen-2-ylmethyl)-1,2-oxazole-4-carboxamide
CID 17173767
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 16560707
methyl 2-[2-[(2-morpholin-4-ylphenyl)methylamino]-2-oxoethyl]benzoate
CID 75440397
2,2,2-trifluoro-N-[(2-morpholin-4-ylphenyl)methyl]acetamide
CID 110443194
3-ethyl-5-methyl-N-(2-phenylcyclopropyl)-1,2-oxazole-4-carboxamide
CID 47734044
3-ethyl-5-methyl-N-[(1R,2R)-2-phenylcyclopropyl]-1,2-oxazole-4-carboxamide
CID 97314194

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide (CID 51096940) is 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide is CCc1noc(C)c1C(=O)NCc1ccccc1N1CCOCC1.
What is the InChIKey of 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide?
The InChIKey is UBCQYGKRHFOGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-3-15-17(13(2)24-20-15)18(22)19-12-14-6-4-5-7-16(14)21-8-10-23-11-9-21/h4-7H,3,8-12H2,1-2H3,(H,19,22).
What are the key properties of 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide?
3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-methyl-N-[(2-morpholin-4-ylphenyl)methyl]-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 51096940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).