(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone

C10H15N3O2 — CID 735604

IUPAC(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C)n(C(=O)N2CCOCC2)n1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(2)13(11-8)10(14)12-3-5-15-6-4-12/h7H,3-6H2,1-2H3
InChIKeyGEEHBRJQDBVTMK-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.80
Rot. Bonds

About (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone

(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone (PubChem CID 735604) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone
PubChem CID735604
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C)n(C(=O)N2CCOCC2)n1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(2)13(11-8)10(14)12-3-5-15-6-4-12/h7H,3-6H2,1-2H3
InChIKeyGEEHBRJQDBVTMK-UHFFFAOYSA-N
XLogP0.80
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone?
The IUPAC name of (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone (CID 735604) is (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone is Cc1cc(C)n(C(=O)N2CCOCC2)n1.
What is the InChIKey of (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone?
The InChIKey is GEEHBRJQDBVTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8-7-9(2)13(11-8)10(14)12-3-5-15-6-4-12/h7H,3-6H2,1-2H3.
What are the key properties of (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone?
(3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone has a molecular weight of 209.25 g/mol, XLogP of 0.80, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylpyrazol-1-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 735604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).