3-(1,3,5-trimethylpyrazol-4-yl)morpholine

C10H17N3O — CID 71695346

IUPAC3-(1,3,5-trimethylpyrazol-4-yl)morpholine
SMILESCc1nn(C)c(C)c1C1COCCN1
InChIInChI=1S/C10H17N3O/c1-7-10(8(2)13(3)12-7)9-6-14-5-4-11-9/h9,11H,4-6H2,1-3H3
InChIKeyCOPZBDLYLMQFFO-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.70
Rot. Bonds1

About 3-(1,3,5-trimethylpyrazol-4-yl)morpholine

3-(1,3,5-trimethylpyrazol-4-yl)morpholine (PubChem CID 71695346) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-(1,3,5-trimethylpyrazol-4-yl)morpholine.

Molecular Properties

Compound Name3-(1,3,5-trimethylpyrazol-4-yl)morpholine
PubChem CID71695346
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-(1,3,5-trimethylpyrazol-4-yl)morpholine
SMILESCc1nn(C)c(C)c1C1COCCN1
InChIInChI=1S/C10H17N3O/c1-7-10(8(2)13(3)12-7)9-6-14-5-4-11-9/h9,11H,4-6H2,1-3H3
InChIKeyCOPZBDLYLMQFFO-UHFFFAOYSA-N
XLogP0.70
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3,5-trimethylpyrazol-4-yl)morpholine?
The IUPAC name of 3-(1,3,5-trimethylpyrazol-4-yl)morpholine (CID 71695346) is 3-(1,3,5-trimethylpyrazol-4-yl)morpholine.
What is the SMILES notation for 3-(1,3,5-trimethylpyrazol-4-yl)morpholine?
The canonical SMILES for 3-(1,3,5-trimethylpyrazol-4-yl)morpholine is Cc1nn(C)c(C)c1C1COCCN1.
What is the InChIKey of 3-(1,3,5-trimethylpyrazol-4-yl)morpholine?
The InChIKey is COPZBDLYLMQFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-10(8(2)13(3)12-7)9-6-14-5-4-11-9/h9,11H,4-6H2,1-3H3.
What are the key properties of 3-(1,3,5-trimethylpyrazol-4-yl)morpholine?
3-(1,3,5-trimethylpyrazol-4-yl)morpholine has a molecular weight of 195.27 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3,5-trimethylpyrazol-4-yl)morpholine is sourced from PubChem (CID 71695346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).