2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone

C10H16N4O2 — CID 94355301

IUPAC2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone
SMILESC[C@@H]1COCCN1C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H16N4O2/c1-8-7-16-5-4-14(8)10(15)6-13-3-2-9(11)12-13/h2-3,8H,4-7H2,1H3,(H2,11,12)/t8-/m1/s1
InChIKeyWRZSWLRBBKEXTE-MRVPVSSYSA-N
MW224.26 g/mol
LogP-0.29
Rot. Bonds2

About 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone

2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone (PubChem CID 94355301) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone
PubChem CID94355301
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone
SMILESC[C@@H]1COCCN1C(=O)Cn1ccc(N)n1
InChIInChI=1S/C10H16N4O2/c1-8-7-16-5-4-14(8)10(15)6-13-3-2-9(11)12-13/h2-3,8H,4-7H2,1H3,(H2,11,12)/t8-/m1/s1
InChIKeyWRZSWLRBBKEXTE-MRVPVSSYSA-N
XLogP-0.29
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone (CID 94355301) is 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone is C[C@@H]1COCCN1C(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone?
The InChIKey is WRZSWLRBBKEXTE-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-8-7-16-5-4-14(8)10(15)6-13-3-2-9(11)12-13/h2-3,8H,4-7H2,1H3,(H2,11,12)/t8-/m1/s1.
What are the key properties of 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone?
2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone has a molecular weight of 224.26 g/mol, XLogP of -0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-1-[(3R)-3-methylmorpholin-4-yl]ethanone is sourced from PubChem (CID 94355301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).