1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine

C15H21N3O2 — CID 106721116

IUPAC1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine
SMILESCOc1ccccc1OCCn1cnc(CC(C)N)c1
InChIInChI=1S/C15H21N3O2/c1-12(16)9-13-10-18(11-17-13)7-8-20-15-6-4-3-5-14(15)19-2/h3-6,10-12H,7-9,16H2,1-2H3
InChIKeyAQAUVCUKDRIDED-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.86
Rot. Bonds7

About 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine

1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine (PubChem CID 106721116) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine.

Molecular Properties

Compound Name1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine
PubChem CID106721116
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine
SMILESCOc1ccccc1OCCn1cnc(CC(C)N)c1
InChIInChI=1S/C15H21N3O2/c1-12(16)9-13-10-18(11-17-13)7-8-20-15-6-4-3-5-14(15)19-2/h3-6,10-12H,7-9,16H2,1-2H3
InChIKeyAQAUVCUKDRIDED-UHFFFAOYSA-N
XLogP1.86
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-phenoxyethyl)imidazol-4-yl]propan-2-amine
CID 106721144
1-[1-[(2-fluoro-3-methoxyphenyl)methyl]imidazol-4-yl]propan-2-amine
CID 106721217
1-[1-[[4-(2-aminopropyl)imidazol-1-yl]methyl]imidazol-4-yl]propan-2-amine
CID 59827554
4-(chloromethyl)-1-[2-(2-ethoxyphenoxy)ethyl]imidazole
CID 106720878
1-[1-[(2-methoxy-5-methylphenyl)methyl]imidazol-4-yl]propan-2-amine
CID 106721192
1-[2-(2-methoxyphenoxy)ethyl]pyrrole
CID 60650106
4-[4-(2-aminopropyl)imidazol-1-yl]butanenitrile
CID 106721187
1-[1-(2-methylsulfonylethyl)imidazol-4-yl]propan-2-amine
CID 106721170
5-[[4-(2-aminopropyl)imidazol-1-yl]methyl]-2-methoxybenzonitrile
CID 106721101
1-[1-[3-(2,2,2-trifluoroethoxy)propyl]imidazol-4-yl]propan-2-amine
CID 106721209
1-[1-(4,4,4-trifluorobutyl)imidazol-4-yl]propan-2-amine
CID 106721010
1-[1-[2-(2-methoxyphenoxy)ethyl]pyrrol-3-yl]butan-1-amine
CID 79108388

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine?
The IUPAC name of 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine (CID 106721116) is 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine.
What is the SMILES notation for 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine?
The canonical SMILES for 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine is COc1ccccc1OCCn1cnc(CC(C)N)c1.
What is the InChIKey of 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine?
The InChIKey is AQAUVCUKDRIDED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-12(16)9-13-10-18(11-17-13)7-8-20-15-6-4-3-5-14(15)19-2/h3-6,10-12H,7-9,16H2,1-2H3.
What are the key properties of 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine?
1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine has a molecular weight of 275.35 g/mol, XLogP of 1.86, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine is sourced from PubChem (CID 106721116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).