4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine

C17H23N3O3 — CID 11544226

IUPAC4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
SMILESCOc1ccc(-n2nc(OCCN3CCOCC3)cc2C)cc1
InChIInChI=1S/C17H23N3O3/c1-14-13-17(23-12-9-19-7-10-22-11-8-19)18-20(14)15-3-5-16(21-2)6-4-15/h3-6,13H,7-12H2,1-2H3
InChIKeyMLMSXMUNOAHWMJ-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.90
Rot. Bonds6

About 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine

4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine (PubChem CID 11544226) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
PubChem CID11544226
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
SMILESCOc1ccc(-n2nc(OCCN3CCOCC3)cc2C)cc1
InChIInChI=1S/C17H23N3O3/c1-14-13-17(23-12-9-19-7-10-22-11-8-19)18-20(14)15-3-5-16(21-2)6-4-15/h3-6,13H,7-12H2,1-2H3
InChIKeyMLMSXMUNOAHWMJ-UHFFFAOYSA-N
XLogP1.90
TPSA48.75 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-(1,5-diphenylpyrazol-3-yl)oxy-N,N-dimethylpropan-1-amine
CID 10314006
4-[2-[1-(3-Chlorophenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
CID 71460635
1-[4-[2-[1-(3,4-Difluorophenyl)-5-methylpyrazol-3-yl]oxyethyl]piperazin-1-yl]ethanone
CID 168279516
4-[2-(5-Methyl-1-phenylpyrazol-3-yl)oxyethyl]morpholine
CID 71456959
6-(4-ethoxyphenyl)-1-methoxy-4,5,7-trimethyl-6H-pyrrolo[3,4-d]pyridazine
CID 44274811
1,5-Dimethyl-3-(phenoxymethyl)pyrazole
CID 82076625
5-Ethoxy-3-methyl-1-phenylpyrazole
CID 555100
Pyrazole, 5-(2-(dimethylamino)ethoxy)-3-methyl-1-phenyl-
CID 199978
Pyrazole, 1-benzyl-3-methyl-5-(2-(4-methyl-1-piperazinyl)ethoxy)-
CID 203748
Poli 66
CID 210669
N-[dimethylamino-(5-ethoxy-3-methyl-1-phenylpyrazol-4-yl)phosphinothioyl]-N-methylmethanamine
CID 2420535
1-((3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl)-4-(2-methoxyphenyl)piperazine
CID 49862152

Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine (CID 11544226) is 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine is COc1ccc(-n2nc(OCCN3CCOCC3)cc2C)cc1.
What is the InChIKey of 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine?
The InChIKey is MLMSXMUNOAHWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-14-13-17(23-12-9-19-7-10-22-11-8-19)18-20(14)15-3-5-16(21-2)6-4-15/h3-6,13H,7-12H2,1-2H3.
What are the key properties of 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine?
4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine has a molecular weight of 317.39 g/mol, XLogP of 1.90, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(4-methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine is sourced from PubChem (CID 11544226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).