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

C18H24N4O3 — CID 75473994

IUPACN-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide
SMILESCCc1cccc(NC(=O)N2CCOCC2c2noc(C(C)C)n2)c1
InChIInChI=1S/C18H24N4O3/c1-4-13-6-5-7-14(10-13)19-18(23)22-8-9-24-11-15(22)16-20-17(12(2)3)25-21-16/h5-7,10,12,15H,4,8-9,11H2,1-3H3,(H,19,23)
InChIKeyUQJHTKHIWFKMNO-UHFFFAOYSA-N
MW344.42 g/mol
LogP3.36
Rot. Bonds4

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

N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide (PubChem CID 75473994) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide
PubChem CID75473994
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide
SMILESCCc1cccc(NC(=O)N2CCOCC2c2noc(C(C)C)n2)c1
InChIInChI=1S/C18H24N4O3/c1-4-13-6-5-7-14(10-13)19-18(23)22-8-9-24-11-15(22)16-20-17(12(2)3)25-21-16/h5-7,10,12,15H,4,8-9,11H2,1-3H3,(H,19,23)
InChIKeyUQJHTKHIWFKMNO-UHFFFAOYSA-N
XLogP3.36
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-phenyl-1-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]propan-1-one
CID 75474925
N,N-diethyl-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide
CID 75484023
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-3-(2-methylpropyl)morpholine-4-carboxamide
CID 56794691
N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine-4-carboxamide
CID 127926168
(2S,4S)-N-(3-ethylphenyl)-4-fluoro-2-(morpholine-4-carbonyl)pyrrolidine-1-carboxamide
CID 110876045
N-(6-methyl-2-pyridinyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide
CID 154753445
N-[3-(1-aminoethyl)phenyl]-3-methylmorpholine-4-carboxamide
CID 61342049
(3S)-3-ethyl-N-[3-[ethyl(methyl)amino]phenyl]morpholine-4-carboxamide
CID 96518024
(3R)-3-(5-ethylfuran-2-yl)-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]morpholine-4-carboxamide
CID 99715180
(3S)-3-(2-methylpropyl)-N-phenylmorpholine-4-carboxamide
CID 95904890
3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-N-(2-propylpyrazol-3-yl)morpholine-4-carboxamide
CID 128997667
(3S)-4-(2-chlorophenyl)sulfonyl-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 97344824

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide?
The IUPAC name of N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide (CID 75473994) is N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide is CCc1cccc(NC(=O)N2CCOCC2c2noc(C(C)C)n2)c1.
What is the InChIKey of N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide?
The InChIKey is UQJHTKHIWFKMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-4-13-6-5-7-14(10-13)19-18(23)22-8-9-24-11-15(22)16-20-17(12(2)3)25-21-16/h5-7,10,12,15H,4,8-9,11H2,1-3H3,(H,19,23).
What are the key properties of N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide?
N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholine-4-carboxamide is sourced from PubChem (CID 75473994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).