2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine

C13H24N4O — CID 79579017

IUPAC2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1c(C(CN)N2CC(C)OCC2C)cnn1C
InChIInChI=1S/C13H24N4O/c1-9-8-18-10(2)7-17(9)13(5-14)12-6-15-16(4)11(12)3/h6,9-10,13H,5,7-8,14H2,1-4H3
InChIKeyRRRYHOGNMXUDIF-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.84
Rot. Bonds3

About 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine

2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine (PubChem CID 79579017) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine
PubChem CID79579017
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1c(C(CN)N2CC(C)OCC2C)cnn1C
InChIInChI=1S/C13H24N4O/c1-9-8-18-10(2)7-17(9)13(5-14)12-6-15-16(4)11(12)3/h6,9-10,13H,5,7-8,14H2,1-4H3
InChIKeyRRRYHOGNMXUDIF-UHFFFAOYSA-N
XLogP0.84
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine (CID 79579017) is 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine is Cc1c(C(CN)N2CC(C)OCC2C)cnn1C.
What is the InChIKey of 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine?
The InChIKey is RRRYHOGNMXUDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-9-8-18-10(2)7-17(9)13(5-14)12-6-15-16(4)11(12)3/h6,9-10,13H,5,7-8,14H2,1-4H3.
What are the key properties of 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine?
2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine has a molecular weight of 252.36 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylmorpholin-4-yl)-2-(1,5-dimethylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 79579017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).