3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine

C11H19N3O — CID 84780835

IUPAC3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine
SMILESCC(C)Cn1nccc1C1COCCN1
InChIInChI=1S/C11H19N3O/c1-9(2)7-14-11(3-4-13-14)10-8-15-6-5-12-10/h3-4,9-10,12H,5-8H2,1-2H3
InChIKeyAQSWMJBPGRHTPM-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.20
Rot. Bonds3

About 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine

3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine (PubChem CID 84780835) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine.

Molecular Properties

Compound Name3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine
PubChem CID84780835
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine
SMILESCC(C)Cn1nccc1C1COCCN1
InChIInChI=1S/C11H19N3O/c1-9(2)7-14-11(3-4-13-14)10-8-15-6-5-12-10/h3-4,9-10,12H,5-8H2,1-2H3
InChIKeyAQSWMJBPGRHTPM-UHFFFAOYSA-N
XLogP1.20
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-prop-2-enylpyrazol-3-yl)morpholine
CID 84772813
3-[4-(2-methylpropoxy)phenyl]morpholine
CID 82291237
3-pyridin-2-ylmorpholine
CID 54247101
(2-ethylpyrazol-3-yl)-morpholin-3-ylmethanone
CID 116576217
3-(2-methyl-4-pyridinyl)morpholine
CID 55282770
3-(3-chloro-4-pyridinyl)morpholine
CID 55273452
3-(5-bromo-1-methylpyrazol-4-yl)morpholine
CID 84803089
3-(2,6-dimethylphenyl)morpholine
CID 55298000
(3S)-3-(2-methyl-5-propan-2-ylphenyl)morpholine
CID 96844502
1-(cyclobutylmethyl)-5-pyrrolidin-2-ylpyrazole
CID 84778724
(3S)-3-(5,6-dichloro-2-pyridinyl)morpholine
CID 130706269
(3S)-3-(4-fluorophenyl)morpholine
CID 22860769

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine?
The IUPAC name of 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine (CID 84780835) is 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine.
What is the SMILES notation for 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine?
The canonical SMILES for 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine is CC(C)Cn1nccc1C1COCCN1.
What is the InChIKey of 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine?
The InChIKey is AQSWMJBPGRHTPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9(2)7-14-11(3-4-13-14)10-8-15-6-5-12-10/h3-4,9-10,12H,5-8H2,1-2H3.
What are the key properties of 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine?
3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine has a molecular weight of 209.29 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methylpropyl)pyrazol-3-yl]morpholine is sourced from PubChem (CID 84780835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).