(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone

C14H23N3O3 — CID 16925365

IUPAC(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
SMILESCCOc1nn(CC)cc1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C14H23N3O3/c1-5-17-9-12(13(15-17)19-6-2)14(18)16-7-10(3)20-11(4)8-16/h9-11H,5-8H2,1-4H3
InChIKeyWGHNAYGWWKVXDG-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.55
Rot. Bonds4

About (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone

(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone (PubChem CID 16925365) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
PubChem CID16925365
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
SMILESCCOc1nn(CC)cc1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C14H23N3O3/c1-5-17-9-12(13(15-17)19-6-2)14(18)16-7-10(3)20-11(4)8-16/h9-11H,5-8H2,1-4H3
InChIKeyWGHNAYGWWKVXDG-UHFFFAOYSA-N
XLogP1.55
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone (CID 16925365) is (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone is CCOc1nn(CC)cc1C(=O)N1CC(C)OC(C)C1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The InChIKey is WGHNAYGWWKVXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-5-17-9-12(13(15-17)19-6-2)14(18)16-7-10(3)20-11(4)8-16/h9-11H,5-8H2,1-4H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
(2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone has a molecular weight of 281.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone is sourced from PubChem (CID 16925365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).