2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine

C13H19N3O — CID 105009117

IUPAC2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
SMILESCCn1ccnc1CC(NC)c1coc(C)c1
InChIInChI=1S/C13H19N3O/c1-4-16-6-5-15-13(16)8-12(14-3)11-7-10(2)17-9-11/h5-7,9,12,14H,4,8H2,1-3H3
InChIKeyCGTGCMXOIXBHFV-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.31
Rot. Bonds5

About 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine

2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine (PubChem CID 105009117) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
PubChem CID105009117
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
SMILESCCn1ccnc1CC(NC)c1coc(C)c1
InChIInChI=1S/C13H19N3O/c1-4-16-6-5-15-13(16)8-12(14-3)11-7-10(2)17-9-11/h5-7,9,12,14H,4,8H2,1-3H3
InChIKeyCGTGCMXOIXBHFV-UHFFFAOYSA-N
XLogP2.31
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(5-methylfuran-3-yl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105011259
1-(3-chloro-5-methylphenyl)-2-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 105009539
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 105009061
1-(4-bromo-3-chlorophenyl)-2-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 105009485
N-methyl-1-(5-methylfuran-3-yl)-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine
CID 104999895
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 105007716
N-ethyl-2-(1-ethylimidazol-2-yl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 79751877
2-(1-ethylimidazol-2-yl)-1-(2-ethylphenyl)-N-methylethanamine
CID 105009546
1-(4-chloro-2-fluorophenyl)-2-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 79752703
N-methyl-1-(5-methylfuran-3-yl)-2-(1-methylpyrazol-3-yl)ethanamine
CID 105025275
[2-(2-ethyl-1,2,4-triazol-3-yl)-1-(5-methylfuran-3-yl)ethyl]hydrazine
CID 105318542
[1-(2-chlorofuran-3-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 106694577

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine (CID 105009117) is 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine is CCn1ccnc1CC(NC)c1coc(C)c1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
The InChIKey is CGTGCMXOIXBHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-4-16-6-5-15-13(16)8-12(14-3)11-7-10(2)17-9-11/h5-7,9,12,14H,4,8H2,1-3H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine?
2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine has a molecular weight of 233.31 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine is sourced from PubChem (CID 105009117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).