2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol

C15H27N3O2 — CID 79669879

IUPAC2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol
SMILESCCCN1CCOC(C(O)Cc2cc(C)nn2CC)C1
InChIInChI=1S/C15H27N3O2/c1-4-6-17-7-8-20-15(11-17)14(19)10-13-9-12(3)16-18(13)5-2/h9,14-15,19H,4-8,10-11H2,1-3H3
InChIKeyNYBZKRJWKZFNGU-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.23
Rot. Bonds6

About 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol

2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol (PubChem CID 79669879) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol
PubChem CID79669879
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol
SMILESCCCN1CCOC(C(O)Cc2cc(C)nn2CC)C1
InChIInChI=1S/C15H27N3O2/c1-4-6-17-7-8-20-15(11-17)14(19)10-13-9-12(3)16-18(13)5-2/h9,14-15,19H,4-8,10-11H2,1-3H3
InChIKeyNYBZKRJWKZFNGU-UHFFFAOYSA-N
XLogP1.23
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol?
The IUPAC name of 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol (CID 79669879) is 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol.
What is the SMILES notation for 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol?
The canonical SMILES for 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol is CCCN1CCOC(C(O)Cc2cc(C)nn2CC)C1.
What is the InChIKey of 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol?
The InChIKey is NYBZKRJWKZFNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-4-6-17-7-8-20-15(11-17)14(19)10-13-9-12(3)16-18(13)5-2/h9,14-15,19H,4-8,10-11H2,1-3H3.
What are the key properties of 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol?
2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol has a molecular weight of 281.40 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol is sourced from PubChem (CID 79669879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).