(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide

C17H22N4O3 — CID 129488275

IUPAC(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide
SMILESCCc1ccc([C@@H]2CN(C(=O)Nc3nc(CC)no3)CCO2)cc1
InChIInChI=1S/C17H22N4O3/c1-3-12-5-7-13(8-6-12)14-11-21(9-10-23-14)17(22)19-16-18-15(4-2)20-24-16/h5-8,14H,3-4,9-11H2,1-2H3,(H,18,19,20,22)/t14-/m0/s1
InChIKeySARWEIJNCPWCIP-AWEZNQCLSA-N
MW330.39 g/mol
LogP2.80
Rot. Bonds4

About (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide

(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide (PubChem CID 129488275) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide
PubChem CID129488275
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide
SMILESCCc1ccc([C@@H]2CN(C(=O)Nc3nc(CC)no3)CCO2)cc1
InChIInChI=1S/C17H22N4O3/c1-3-12-5-7-13(8-6-12)14-11-21(9-10-23-14)17(22)19-16-18-15(4-2)20-24-16/h5-8,14H,3-4,9-11H2,1-2H3,(H,18,19,20,22)/t14-/m0/s1
InChIKeySARWEIJNCPWCIP-AWEZNQCLSA-N
XLogP2.80
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(4-ethylphenyl)-N-pyridazin-4-ylmorpholine-4-carboxamide
CID 129488391
N-(4-ethylphenyl)-2-phenylmorpholine-4-carboxamide
CID 84526380
1-[2-(4-ethylphenyl)morpholin-4-yl]ethanone
CID 71684128
(2S)-2-(4-ethylphenyl)-N-pyridazin-3-ylmorpholine-4-carboxamide
CID 124624060
N-cyclohexyl-2-(4-ethylphenyl)morpholine-4-carboxamide
CID 110364020
(4-ethylphenyl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 84545325
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
2-(1,2-benzoxazol-3-yl)-1-[(2R)-2-(4-ethylphenyl)morpholin-4-yl]ethanone
CID 164630726
N-(3-ethyl-1,2,4-oxadiazol-5-yl)-3,3-difluoropyrrolidine-1-carboxamide
CID 128633425
(3,4-difluorophenyl)-[2-(4-ethylphenyl)morpholin-4-yl]methanone
CID 110364027
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
CID 110364025
4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide
CID 16894751

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide?
The IUPAC name of (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide (CID 129488275) is (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide?
The canonical SMILES for (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide is CCc1ccc([C@@H]2CN(C(=O)Nc3nc(CC)no3)CCO2)cc1.
What is the InChIKey of (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide?
The InChIKey is SARWEIJNCPWCIP-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-3-12-5-7-13(8-6-12)14-11-21(9-10-23-14)17(22)19-16-18-15(4-2)20-24-16/h5-8,14H,3-4,9-11H2,1-2H3,(H,18,19,20,22)/t14-/m0/s1.
What are the key properties of (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide?
(2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-(4-ethylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 129488275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).