4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine

C12H21N3O2 — CID 116805370

IUPAC4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine
SMILESCC(C)n1cc(OCCN2CCOCC2)cn1
InChIInChI=1S/C12H21N3O2/c1-11(2)15-10-12(9-13-15)17-8-5-14-3-6-16-7-4-14/h9-11H,3-8H2,1-2H3
InChIKeyGNTFVGVIWSTGOB-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.17
Rot. Bonds5

About 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine

4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine (PubChem CID 116805370) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine
PubChem CID116805370
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine
SMILESCC(C)n1cc(OCCN2CCOCC2)cn1
InChIInChI=1S/C12H21N3O2/c1-11(2)15-10-12(9-13-15)17-8-5-14-3-6-16-7-4-14/h9-11H,3-8H2,1-2H3
InChIKeyGNTFVGVIWSTGOB-UHFFFAOYSA-N
XLogP1.17
TPSA39.52 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1-propan-2-ylpyrazol-4-yl)oxypropan-1-amine
CID 116800727
4-[2-(3-iodoimidazo[1,2-b]pyridazin-7-yl)oxyethyl]morpholine
CID 155367109
4-(3-phenoxypropoxy)-1-propan-2-ylpyrazole
CID 116805200
1-[4-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43503698
4-[2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)oxyethyl]morpholine
CID 155727791
3-morpholin-4-yl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]propan-1-amine;dihydrochloride
CID 126967380
1-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]pyridin-2-one
CID 116805480
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 3386987
4-[2-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenoxy]ethyl]morpholine
CID 134179285
4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine
CID 58923289
1-[5-(2-morpholin-4-ylethoxy)-2-pyridinyl]butan-2-amine
CID 79796010

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine?
The IUPAC name of 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine (CID 116805370) is 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine.
What is the SMILES notation for 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine?
The canonical SMILES for 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine is CC(C)n1cc(OCCN2CCOCC2)cn1.
What is the InChIKey of 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine?
The InChIKey is GNTFVGVIWSTGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-11(2)15-10-12(9-13-15)17-8-5-14-3-6-16-7-4-14/h9-11H,3-8H2,1-2H3.
What are the key properties of 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine?
4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine has a molecular weight of 239.32 g/mol, XLogP of 1.17, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine is sourced from PubChem (CID 116805370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).