1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine

C15H28N4O — CID 79083525

IUPAC1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
SMILESCCn1nc(C)c(C(C)NCC2CN(C)CCO2)c1C
InChIInChI=1S/C15H28N4O/c1-6-19-13(4)15(12(3)17-19)11(2)16-9-14-10-18(5)7-8-20-14/h11,14,16H,6-10H2,1-5H3
InChIKeyUQIMBFXHHGYNDX-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.50
Rot. Bonds5

About 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine

1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine (PubChem CID 79083525) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
PubChem CID79083525
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
SMILESCCn1nc(C)c(C(C)NCC2CN(C)CCO2)c1C
InChIInChI=1S/C15H28N4O/c1-6-19-13(4)15(12(3)17-19)11(2)16-9-14-10-18(5)7-8-20-14/h11,14,16H,6-10H2,1-5H3
InChIKeyUQIMBFXHHGYNDX-UHFFFAOYSA-N
XLogP1.50
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]ethanamine
CID 115717464
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 103778780
[4-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]morpholin-2-yl]methanamine
CID 114397778
1-(2,5-dimethylphenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 78946775
3-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356168
N-[(4-ethylmorpholin-2-yl)methyl]-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine
CID 114399660
3-cyclopentyl-N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]propan-1-amine
CID 103776522
(1R)-1-(4-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81359066
1-(3,4-dichlorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 78960515
(1S)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383986
(1R)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383657

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine?
The IUPAC name of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine (CID 79083525) is 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine.
What is the SMILES notation for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine?
The canonical SMILES for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine is CCn1nc(C)c(C(C)NCC2CN(C)CCO2)c1C.
What is the InChIKey of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine?
The InChIKey is UQIMBFXHHGYNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-6-19-13(4)15(12(3)17-19)11(2)16-9-14-10-18(5)7-8-20-14/h11,14,16H,6-10H2,1-5H3.
What are the key properties of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine?
1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine has a molecular weight of 280.42 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine is sourced from PubChem (CID 79083525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).