4-(2-pyrazol-1-ylethyl)morpholine

C9H15N3O — CID 46739602

IUPAC4-(2-pyrazol-1-ylethyl)morpholine
SMILESc1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C9H15N3O/c1-2-10-12(3-1)5-4-11-6-8-13-9-7-11/h1-3H,4-9H2
InChIKeyARTZLKMWNRZIIH-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.22
Rot. Bonds3

About 4-(2-pyrazol-1-ylethyl)morpholine

4-(2-pyrazol-1-ylethyl)morpholine (PubChem CID 46739602) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 4-(2-pyrazol-1-ylethyl)morpholine.

Molecular Properties

Compound Name4-(2-pyrazol-1-ylethyl)morpholine
PubChem CID46739602
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name4-(2-pyrazol-1-ylethyl)morpholine
SMILESc1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C9H15N3O/c1-2-10-12(3-1)5-4-11-6-8-13-9-7-11/h1-3H,4-9H2
InChIKeyARTZLKMWNRZIIH-UHFFFAOYSA-N
XLogP0.22
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-pyrazol-1-ylethyl)morpholine?
The IUPAC name of 4-(2-pyrazol-1-ylethyl)morpholine (CID 46739602) is 4-(2-pyrazol-1-ylethyl)morpholine.
What is the SMILES notation for 4-(2-pyrazol-1-ylethyl)morpholine?
The canonical SMILES for 4-(2-pyrazol-1-ylethyl)morpholine is c1cnn(CCN2CCOCC2)c1.
What is the InChIKey of 4-(2-pyrazol-1-ylethyl)morpholine?
The InChIKey is ARTZLKMWNRZIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-2-10-12(3-1)5-4-11-6-8-13-9-7-11/h1-3H,4-9H2.
What are the key properties of 4-(2-pyrazol-1-ylethyl)morpholine?
4-(2-pyrazol-1-ylethyl)morpholine has a molecular weight of 181.24 g/mol, XLogP of 0.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyrazol-1-ylethyl)morpholine is sourced from PubChem (CID 46739602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).