2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine

C13H17N3O2 — CID 117190683

IUPAC2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine
SMILESCOc1ccccc1Oc1ncc(N)n1C(C)C
InChIInChI=1S/C13H17N3O2/c1-9(2)16-12(14)8-15-13(16)18-11-7-5-4-6-10(11)17-3/h4-9H,14H2,1-3H3
InChIKeyFDSDXLKIJWCLRE-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.85
Rot. Bonds4

About 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine

2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine (PubChem CID 117190683) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine
PubChem CID117190683
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine
SMILESCOc1ccccc1Oc1ncc(N)n1C(C)C
InChIInChI=1S/C13H17N3O2/c1-9(2)16-12(14)8-15-13(16)18-11-7-5-4-6-10(11)17-3/h4-9H,14H2,1-3H3
InChIKeyFDSDXLKIJWCLRE-UHFFFAOYSA-N
XLogP2.85
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-5-(2-methoxyphenoxy)-1-propan-2-ylpyrrole-2-carbonitrile
CID 100774221
4-[(2-methoxyphenoxy)methyl]-1-propan-2-ylpyrazol-5-amine
CID 117216723
4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine
CID 80869201
5-(2-methoxyphenyl)-4-propan-2-yl-1,2,4-triazole-3-sulfonamide
CID 113366285
2-ethyl-5-(2-methoxyphenyl)-3-propan-2-ylimidazol-4-amine
CID 62220440
(1S)-1-[2-(2-methoxyphenoxy)-3-pyridinyl]ethanamine
CID 114056631
5-chloro-2-(2-methoxyphenoxy)pyridine
CID 66233202
(1S)-1-[5-(2-methoxyphenoxy)-2-pyridinyl]ethanol
CID 83124880
azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
bis(2-methoxyphenyl)-dimethylphosphanium
CID 102310602
6-(2-methoxyphenoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80988180

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine?
The IUPAC name of 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine (CID 117190683) is 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine?
The canonical SMILES for 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine is COc1ccccc1Oc1ncc(N)n1C(C)C.
What is the InChIKey of 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine?
The InChIKey is FDSDXLKIJWCLRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-9(2)16-12(14)8-15-13(16)18-11-7-5-4-6-10(11)17-3/h4-9H,14H2,1-3H3.
What are the key properties of 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine?
2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine has a molecular weight of 247.30 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-3-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 117190683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).