[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride

C14H23ClN4O3 — CID 119775650

IUPAC[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride
SMILESCc1nc(CC2CCCN(C(=O)C3CNCCO3)C2)no1.Cl
InChIInChI=1S/C14H22N4O3.ClH/c1-10-16-13(17-21-10)7-11-3-2-5-18(9-11)14(19)12-8-15-4-6-20-12;/h11-12,15H,2-9H2,1H3;1H
InChIKeyNVUBULPCXRQWHQ-UHFFFAOYSA-N
MW330.82 g/mol
LogP0.57
Rot. Bonds3

About [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride

[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride (PubChem CID 119775650) has the molecular formula C14H23ClN4O3 and a molecular weight of 330.82 g/mol. Its IUPAC name is [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride.

Molecular Properties

Compound Name[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride
PubChem CID119775650
Molecular FormulaC14H23ClN4O3
Molecular Weight330.82 g/mol
Exact Mass330.15
IUPAC Name[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride
SMILESCc1nc(CC2CCCN(C(=O)C3CNCCO3)C2)no1.Cl
InChIInChI=1S/C14H22N4O3.ClH/c1-10-16-13(17-21-10)7-11-3-2-5-18(9-11)14(19)12-8-15-4-6-20-12;/h11-12,15H,2-9H2,1H3;1H
InChIKeyNVUBULPCXRQWHQ-UHFFFAOYSA-N
XLogP0.57
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride with MolForge

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Related Compounds

[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-[(2S)-piperidin-2-yl]methanone
CID 124697986
(2S)-2-amino-3,3-dimethyl-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]butan-1-one;hydrochloride
CID 119775634
[(2S,3aR,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl]-[(3S)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]methanone
CID 124778052
2-(1-aminocyclobutyl)-1-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]ethanone
CID 124697978
3-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981550
[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone
CID 119881486
2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride
CID 119775640
4-amino-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]pentan-1-one
CID 120562335
[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
CID 107222846
(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-prop-2-enylpiperidine-1-carboxamide
CID 97074173
[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-4-yl)methanone
CID 124626357
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]morpholine-2-carboxamide
CID 103811683

Frequently Asked Questions

What is the IUPAC name of [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride?
The IUPAC name of [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride (CID 119775650) is [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride.
What is the SMILES notation for [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride?
The canonical SMILES for [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride is Cc1nc(CC2CCCN(C(=O)C3CNCCO3)C2)no1.Cl.
What is the InChIKey of [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride?
The InChIKey is NVUBULPCXRQWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3.ClH/c1-10-16-13(17-21-10)7-11-3-2-5-18(9-11)14(19)12-8-15-4-6-20-12;/h11-12,15H,2-9H2,1H3;1H.
What are the key properties of [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride?
[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride has a molecular weight of 330.82 g/mol, XLogP of 0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride is sourced from PubChem (CID 119775650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).