2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone

C11H18N4O2 — CID 43544114

IUPAC2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)Cn2cc(N)cn2)C(C)CO1
InChIInChI=1S/C11H18N4O2/c1-8-7-17-9(2)4-15(8)11(16)6-14-5-10(12)3-13-14/h3,5,8-9H,4,6-7,12H2,1-2H3
InChIKeyUJAWKXSAQCYLGX-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.10
Rot. Bonds2

About 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone

2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone (PubChem CID 43544114) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
PubChem CID43544114
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)Cn2cc(N)cn2)C(C)CO1
InChIInChI=1S/C11H18N4O2/c1-8-7-17-9(2)4-15(8)11(16)6-14-5-10(12)3-13-14/h3,5,8-9H,4,6-7,12H2,1-2H3
InChIKeyUJAWKXSAQCYLGX-UHFFFAOYSA-N
XLogP0.10
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone (CID 43544114) is 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)Cn2cc(N)cn2)C(C)CO1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The InChIKey is UJAWKXSAQCYLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8-7-17-9(2)4-15(8)11(16)6-14-5-10(12)3-13-14/h3,5,8-9H,4,6-7,12H2,1-2H3.
What are the key properties of 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone has a molecular weight of 238.29 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 43544114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).