2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine

C16H28N4O — CID 79665532

IUPAC2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine
SMILESCCN1CCOC(C(N)Cc2ccn(C3CCCC3)n2)C1
InChIInChI=1S/C16H28N4O/c1-2-19-9-10-21-16(12-19)15(17)11-13-7-8-20(18-13)14-5-3-4-6-14/h7-8,14-16H,2-6,9-12,17H2,1H3
InChIKeyYNDBRXLMYNZYPQ-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.59
Rot. Bonds5

About 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine

2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine (PubChem CID 79665532) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine
PubChem CID79665532
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine
SMILESCCN1CCOC(C(N)Cc2ccn(C3CCCC3)n2)C1
InChIInChI=1S/C16H28N4O/c1-2-19-9-10-21-16(12-19)15(17)11-13-7-8-20(18-13)14-5-3-4-6-14/h7-8,14-16H,2-6,9-12,17H2,1H3
InChIKeyYNDBRXLMYNZYPQ-UHFFFAOYSA-N
XLogP1.59
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The IUPAC name of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine (CID 79665532) is 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine.
What is the SMILES notation for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The canonical SMILES for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine is CCN1CCOC(C(N)Cc2ccn(C3CCCC3)n2)C1.
What is the InChIKey of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The InChIKey is YNDBRXLMYNZYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-2-19-9-10-21-16(12-19)15(17)11-13-7-8-20(18-13)14-5-3-4-6-14/h7-8,14-16H,2-6,9-12,17H2,1H3.
What are the key properties of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine?
2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine has a molecular weight of 292.43 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanamine is sourced from PubChem (CID 79665532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).