N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine

C16H30N4O — CID 79664014

IUPACN-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine
SMILESCCCN1CCOC(C(Cc2cnn(CC)c2)NCC)C1
InChIInChI=1S/C16H30N4O/c1-4-7-19-8-9-21-16(13-19)15(17-5-2)10-14-11-18-20(6-3)12-14/h11-12,15-17H,4-10,13H2,1-3H3
InChIKeyLYUSCTFGCNHXAB-UHFFFAOYSA-N
MW294.44 g/mol
LogP1.53
Rot. Bonds8

About N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine

N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine (PubChem CID 79664014) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine
PubChem CID79664014
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC NameN-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine
SMILESCCCN1CCOC(C(Cc2cnn(CC)c2)NCC)C1
InChIInChI=1S/C16H30N4O/c1-4-7-19-8-9-21-16(13-19)15(17-5-2)10-14-11-18-20(6-3)12-14/h11-12,15-17H,4-10,13H2,1-3H3
InChIKeyLYUSCTFGCNHXAB-UHFFFAOYSA-N
XLogP1.53
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 79662546
N-ethyl-1-(4-propylmorpholin-2-yl)-2-thiophen-3-ylethanamine
CID 79657173
1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 79666951
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl)-N-ethyl-2-(1-ethylpyrazol-4-yl)ethanamine
CID 79095875
[(1-ethylpyrazol-4-yl)-(4-propylmorpholin-2-yl)methyl]hydrazine
CID 105247836
N-ethyl-2-(3-fluorophenyl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79663996
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79664229
N-ethyl-1-(4-propylmorpholin-2-yl)-2-thiophen-2-ylethanamine
CID 79657789
1-(1,4-dimethylpiperazin-2-yl)-N-ethyl-2-(1-ethylpyrazol-4-yl)ethanamine
CID 79658853
2-(5-bromothiophen-2-yl)-N-ethyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79657714
2-(4-bromothiophen-2-yl)-N-ethyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79658332
N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(4-fluorophenyl)ethanamine
CID 79668876

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine (CID 79664014) is N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine is CCCN1CCOC(C(Cc2cnn(CC)c2)NCC)C1.
What is the InChIKey of N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine?
The InChIKey is LYUSCTFGCNHXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-4-7-19-8-9-21-16(13-19)15(17-5-2)10-14-11-18-20(6-3)12-14/h11-12,15-17H,4-10,13H2,1-3H3.
What are the key properties of N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine?
N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine has a molecular weight of 294.44 g/mol, XLogP of 1.53, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine is sourced from PubChem (CID 79664014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).