2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine

C15H26N4O2 — CID 79663243

IUPAC2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine
SMILESCCCN1CCOC(c2noc(C3(C)CCNCC3)n2)C1
InChIInChI=1S/C15H26N4O2/c1-3-8-19-9-10-20-12(11-19)13-17-14(21-18-13)15(2)4-6-16-7-5-15/h12,16H,3-11H2,1-2H3
InChIKeyUMYFKJIWCJXMEP-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.49
Rot. Bonds4

About 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine

2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine (PubChem CID 79663243) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine.

Molecular Properties

Compound Name2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine
PubChem CID79663243
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine
SMILESCCCN1CCOC(c2noc(C3(C)CCNCC3)n2)C1
InChIInChI=1S/C15H26N4O2/c1-3-8-19-9-10-20-12(11-19)13-17-14(21-18-13)15(2)4-6-16-7-5-15/h12,16H,3-11H2,1-2H3
InChIKeyUMYFKJIWCJXMEP-UHFFFAOYSA-N
XLogP1.49
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-4-ol
CID 106950322
1-[3-(4-ethylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine
CID 79666735
3-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]propan-1-ol
CID 79657503
N-[[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
CID 79668683
(1S)-1-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 104915391
2-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]butan-1-amine
CID 79669363
1-[3-(4-ethylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]-4-methylcyclohexan-1-amine
CID 79665328
2-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]pentan-3-amine
CID 79658044
2-[5-(3-ethylpyrrolidin-3-yl)-1,2,4-oxadiazol-3-yl]-4-propan-2-ylmorpholine
CID 79664906
2-methyl-3-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]propanenitrile
CID 106525813
4-[3-(4-ethylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]-4-methyloxolan-3-amine
CID 79666653
3,3-dimethyl-1-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]butan-2-ol
CID 79664685

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine?
The IUPAC name of 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine (CID 79663243) is 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine.
What is the SMILES notation for 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine?
The canonical SMILES for 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine is CCCN1CCOC(c2noc(C3(C)CCNCC3)n2)C1.
What is the InChIKey of 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine?
The InChIKey is UMYFKJIWCJXMEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-3-8-19-9-10-20-12(11-19)13-17-14(21-18-13)15(2)4-6-16-7-5-15/h12,16H,3-11H2,1-2H3.
What are the key properties of 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine?
2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine has a molecular weight of 294.40 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-4-propylmorpholine is sourced from PubChem (CID 79663243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).