N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine

C11H21N3O — CID 63970852

IUPACN-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine
SMILESCCCn1ccnc1C(COC)NCC
InChIInChI=1S/C11H21N3O/c1-4-7-14-8-6-13-11(14)10(9-15-3)12-5-2/h6,8,10,12H,4-5,7,9H2,1-3H3
InChIKeyLLTOOXINTNGSJV-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.59
Rot. Bonds7

About N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine

N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine (PubChem CID 63970852) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine
PubChem CID63970852
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine
SMILESCCCn1ccnc1C(COC)NCC
InChIInChI=1S/C11H21N3O/c1-4-7-14-8-6-13-11(14)10(9-15-3)12-5-2/h6,8,10,12H,4-5,7,9H2,1-3H3
InChIKeyLLTOOXINTNGSJV-UHFFFAOYSA-N
XLogP1.59
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-methoxy-1-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105207224
N-[1-(1-ethylimidazol-2-yl)-2-methoxyethyl]propan-1-amine
CID 63967707
N-ethyl-1-(1-ethylimidazol-2-yl)-2-(2-methoxyethoxy)ethanamine
CID 114032819
4-methoxy-N,3-dimethyl-1-(1-propylimidazol-2-yl)butan-1-amine
CID 105148962
N-ethyl-1-(1-propylimidazol-2-yl)nonan-1-amine
CID 115859033
N-ethyl-3-methylsulfanyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 105148894
2-butan-2-ylsulfanyl-N-ethyl-1-(1-propylimidazol-2-yl)ethanamine
CID 65136269
N-ethyl-2-methyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 63967916
N-propyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 63969166
N-ethyl-1-(1-propylimidazol-2-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 105148851
3-ethoxy-N-ethyl-1-(1-ethylimidazol-2-yl)propan-1-amine
CID 105149887
N-ethyl-1-methoxy-3-(2-propan-2-ylimidazol-1-yl)propan-2-amine
CID 107506086

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine (CID 63970852) is N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine is CCCn1ccnc1C(COC)NCC.
What is the InChIKey of N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine?
The InChIKey is LLTOOXINTNGSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-4-7-14-8-6-13-11(14)10(9-15-3)12-5-2/h6,8,10,12H,4-5,7,9H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine?
N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine has a molecular weight of 211.31 g/mol, XLogP of 1.59, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-1-(1-propylimidazol-2-yl)ethanamine is sourced from PubChem (CID 63970852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).