2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine

C12H22N4O — CID 115291142

IUPAC2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
SMILESCCC1CN(CC(N)c2cnn(C)c2)CCO1
InChIInChI=1S/C12H22N4O/c1-3-11-8-16(4-5-17-11)9-12(13)10-6-14-15(2)7-10/h6-7,11-12H,3-5,8-9,13H2,1-2H3
InChIKeyPVDWJKWPTOUKIS-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.53
Rot. Bonds4

About 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine

2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine (PubChem CID 115291142) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
PubChem CID115291142
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
SMILESCCC1CN(CC(N)c2cnn(C)c2)CCO1
InChIInChI=1S/C12H22N4O/c1-3-11-8-16(4-5-17-11)9-12(13)10-6-14-15(2)7-10/h6-7,11-12H,3-5,8-9,13H2,1-2H3
InChIKeyPVDWJKWPTOUKIS-UHFFFAOYSA-N
XLogP0.53
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,4-dimethylphenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562594
2-(4-ethylpiperidin-1-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291197
2-(4-ethylpiperazin-1-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 113280007
2-(2-ethylmorpholin-4-yl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 43562607
2-(2,2-dimethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291150
(2S)-1-(2-ethylmorpholin-4-yl)propan-2-amine
CID 103934483
2-(3-ethoxypiperidin-1-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291229
N-[(4-ethylmorpholin-2-yl)methyl]-1-(1-methylpyrazol-4-yl)ethanamine
CID 113353975
1-(2,4-dimethylphenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562608
1-(1-methylpyrazol-4-yl)-2-thiomorpholin-4-ylethanamine
CID 115291117
2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 113280017
3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
CID 43562330

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine (CID 115291142) is 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine is CCC1CN(CC(N)c2cnn(C)c2)CCO1.
What is the InChIKey of 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine?
The InChIKey is PVDWJKWPTOUKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-3-11-8-16(4-5-17-11)9-12(13)10-6-14-15(2)7-10/h6-7,11-12H,3-5,8-9,13H2,1-2H3.
What are the key properties of 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine?
2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine has a molecular weight of 238.33 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 115291142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).