N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide

C16H24N4O4 — CID 127772381

IUPACN-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide
SMILESCC(NC(=O)C1CCCCC1)C(=O)N1CCOCC1c1ncon1
InChIInChI=1S/C16H24N4O4/c1-11(18-15(21)12-5-3-2-4-6-12)16(22)20-7-8-23-9-13(20)14-17-10-24-19-14/h10-13H,2-9H2,1H3,(H,18,21)
InChIKeyAPDSIFBJYGWLNL-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.05
Rot. Bonds4

About N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide

N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide (PubChem CID 127772381) has the molecular formula C16H24N4O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide
PubChem CID127772381
Molecular FormulaC16H24N4O4
Molecular Weight336.39 g/mol
Exact Mass336.18
IUPAC NameN-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide
SMILESCC(NC(=O)C1CCCCC1)C(=O)N1CCOCC1c1ncon1
InChIInChI=1S/C16H24N4O4/c1-11(18-15(21)12-5-3-2-4-6-12)16(22)20-7-8-23-9-13(20)14-17-10-24-19-14/h10-13H,2-9H2,1H3,(H,18,21)
InChIKeyAPDSIFBJYGWLNL-UHFFFAOYSA-N
XLogP1.05
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(3S)-3-(1,2,4-oxadiazol-3-yl)morpholine-4-carbonyl]-6-propan-2-yl-1H-pyridin-2-one
CID 124885400
4-[(3R)-3-(1,2,4-oxadiazol-3-yl)morpholine-4-carbonyl]-6-propan-2-yl-1H-pyridin-2-one
CID 124885404
2-(cyclopropylmethoxy)-1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethanone
CID 127772425
N,N-dimethyl-2-(1,2,4-oxadiazol-3-yl)azepane-1-carboxamide
CID 91650313
2-(4-methylphenyl)-1-[(3S)-3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]ethanone
CID 97252445
(2S)-2-(5-tert-butyltetrazol-1-yl)-1-[(2S)-2-(1,2,4-oxadiazol-3-yl)azepan-1-yl]propan-1-one
CID 125138327
3-(3,5-dimethylphenoxy)-1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]propan-1-one
CID 75470555
1-[2-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]propan-1-one
CID 166211162
3-(2-chlorophenyl)sulfanyl-1-[(3R)-3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]propan-1-one
CID 97331620
[2-(2-methylpropyl)-1,3-thiazol-4-yl]-[(3R)-3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]methanone
CID 124744411
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]cyclopropanecarboxamide
CID 110347737
N-(1-oxo-1-piperidin-1-ylpropan-2-yl)cyclopentanecarboxamide
CID 42702289

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide (CID 127772381) is N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide is CC(NC(=O)C1CCCCC1)C(=O)N1CCOCC1c1ncon1.
What is the InChIKey of N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide?
The InChIKey is APDSIFBJYGWLNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O4/c1-11(18-15(21)12-5-3-2-4-6-12)16(22)20-7-8-23-9-13(20)14-17-10-24-19-14/h10-13H,2-9H2,1H3,(H,18,21).
What are the key properties of N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide?
N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide has a molecular weight of 336.39 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide is sourced from PubChem (CID 127772381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).