N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride

C15H23ClN6O3 — CID 154906711

IUPACN-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride
SMILESCOCc1noc(CNC(=O)Cn2ccc(C3CCCNC3)n2)n1.Cl
InChIInChI=1S/C15H22N6O3.ClH/c1-23-10-13-18-15(24-20-13)8-17-14(22)9-21-6-4-12(19-21)11-3-2-5-16-7-11;/h4,6,11,16H,2-3,5,7-10H2,1H3,(H,17,22);1H
InChIKeyXPJMBWKZGMWPHP-UHFFFAOYSA-N
MW370.84 g/mol
LogP0.62
Rot. Bonds7

About N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride

N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride (PubChem CID 154906711) has the molecular formula C15H23ClN6O3 and a molecular weight of 370.84 g/mol. Its IUPAC name is N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride
PubChem CID154906711
Molecular FormulaC15H23ClN6O3
Molecular Weight370.84 g/mol
Exact Mass370.15
IUPAC NameN-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride
SMILESCOCc1noc(CNC(=O)Cn2ccc(C3CCCNC3)n2)n1.Cl
InChIInChI=1S/C15H22N6O3.ClH/c1-23-10-13-18-15(24-20-13)8-17-14(22)9-21-6-4-12(19-21)11-3-2-5-16-7-11;/h4,6,11,16H,2-3,5,7-10H2,1H3,(H,17,22);1H
InChIKeyXPJMBWKZGMWPHP-UHFFFAOYSA-N
XLogP0.62
TPSA107.10 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

2-(3-piperidin-3-ylpyrazol-1-yl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide;hydrochloride
CID 154905881
2-(3-piperidin-3-ylpyrazol-1-yl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
CID 119066073
N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide
CID 119069734
N-[(2-methylphenyl)methyl]-2-[3-[(3S)-piperidin-3-yl]pyrazol-1-yl]acetamide
CID 126426695
2-(3-piperidin-3-ylpyrazol-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 119059529
N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-[3-[(3S)-piperidin-3-yl]pyrazol-1-yl]acetamide
CID 126438280
2-[3-[(3S)-piperidin-3-yl]pyrazol-1-yl]-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)acetamide
CID 126423858
N-[(3-fluorophenyl)methyl]-2-[3-[(3S)-piperidin-3-yl]pyrazol-1-yl]acetamide
CID 126442555
N-[(3-fluorophenyl)methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide
CID 119068979
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride
CID 154906002
N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide
CID 119068274
N-(2-phenoxyethyl)-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide
CID 119072989

Frequently Asked Questions

What is the IUPAC name of N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride?
The IUPAC name of N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride (CID 154906711) is N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride.
What is the SMILES notation for N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride?
The canonical SMILES for N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride is COCc1noc(CNC(=O)Cn2ccc(C3CCCNC3)n2)n1.Cl.
What is the InChIKey of N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride?
The InChIKey is XPJMBWKZGMWPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6O3.ClH/c1-23-10-13-18-15(24-20-13)8-17-14(22)9-21-6-4-12(19-21)11-3-2-5-16-7-11;/h4,6,11,16H,2-3,5,7-10H2,1H3,(H,17,22);1H.
What are the key properties of N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride?
N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride has a molecular weight of 370.84 g/mol, XLogP of 0.62, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(3-piperidin-3-ylpyrazol-1-yl)acetamide;hydrochloride is sourced from PubChem (CID 154906711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).