N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine

C16H30N4O — CID 79662546

IUPACN-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cnn(CC)c1)C1CN(CC)CCO1
InChIInChI=1S/C16H30N4O/c1-4-7-17-15(10-14-11-18-20(6-3)12-14)16-13-19(5-2)8-9-21-16/h11-12,15-17H,4-10,13H2,1-3H3
InChIKeyZGXRHKRTWXELLN-UHFFFAOYSA-N
MW294.44 g/mol
LogP1.53
Rot. Bonds8

About N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine

N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine (PubChem CID 79662546) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
PubChem CID79662546
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC NameN-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cnn(CC)c1)C1CN(CC)CCO1
InChIInChI=1S/C16H30N4O/c1-4-7-17-15(10-14-11-18-20(6-3)12-14)16-13-19(5-2)8-9-21-16/h11-12,15-17H,4-10,13H2,1-3H3
InChIKeyZGXRHKRTWXELLN-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-ethyl-2-(1-ethylpyrazol-4-yl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79664014
1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 79666951
N-[1-(4-ethylmorpholin-2-yl)-2-(4-fluorophenyl)ethyl]propan-1-amine
CID 79665908
N-[2-(1-methylpyrazol-4-yl)-1-(4-propan-2-ylmorpholin-2-yl)ethyl]propan-1-amine
CID 79665970
3-[2-(4-ethylmorpholin-2-yl)-2-(propylamino)ethyl]pyridin-4-amine
CID 79662541
3-[2-(4-ethylmorpholin-2-yl)-2-(propylamino)ethyl]pyridin-2-amine
CID 79662549
N-[(1-ethylpyrazol-4-yl)-(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79093371
N-[1-(4-ethylcyclohexyl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 65393126
N-[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 64984075
N-[2-(1-methyltriazol-4-yl)-1-(4-propylmorpholin-2-yl)ethyl]propan-1-amine
CID 107050193
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
N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(4-fluorophenyl)ethanamine
CID 79668876

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine (CID 79662546) is N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine is CCCNC(Cc1cnn(CC)c1)C1CN(CC)CCO1.
What is the InChIKey of N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine?
The InChIKey is ZGXRHKRTWXELLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-4-7-17-15(10-14-11-18-20(6-3)12-14)16-13-19(5-2)8-9-21-16/h11-12,15-17H,4-10,13H2,1-3H3.
What are the key properties of N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine?
N-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine 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-[1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine is sourced from PubChem (CID 79662546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).