4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine

C12H15N3O2 — CID 117191477

IUPAC4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine
SMILESCOc1ccccc1OCc1cn(C)c(N)n1
InChIInChI=1S/C12H15N3O2/c1-15-7-9(14-12(15)13)8-17-11-6-4-3-5-10(11)16-2/h3-7H,8H2,1-2H3,(H2,13,14)
InChIKeyKLOFWCRSHLASBJ-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.59
Rot. Bonds4

About 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine

4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine (PubChem CID 117191477) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine.

Molecular Properties

Compound Name4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine
PubChem CID117191477
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine
SMILESCOc1ccccc1OCc1cn(C)c(N)n1
InChIInChI=1S/C12H15N3O2/c1-15-7-9(14-12(15)13)8-17-11-6-4-3-5-10(11)16-2/h3-7H,8H2,1-2H3,(H2,13,14)
InChIKeyKLOFWCRSHLASBJ-UHFFFAOYSA-N
XLogP1.59
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-4-(phenoxymethyl)imidazol-2-amine
CID 117191438
4-[(2-methoxyphenoxy)methyl]-1,3-oxazol-2-amine
CID 117190945
2-[(2-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117256132
[5-[(2-methoxyphenoxy)methyl]-1-methyltriazol-4-yl]methanamine
CID 82207915
[5-[(2-methoxyphenoxy)methyl]furan-2-yl]methanamine
CID 55077285
[2-[(2-methoxyphenoxy)methyl]-3-pyridinyl]methanamine
CID 114199233
2-[(2-methoxyphenoxy)methyl]-6-methylpyrimidin-4-amine
CID 3051325
1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-amine
CID 2984464
2-[(2-methoxyphenoxy)methyl]-6-methylpyrimidin-4-amine;hydrochloride
CID 3051324
5-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-amine
CID 117214469
[3-[(2-methoxyphenoxy)methyl]-1-methylindol-5-yl]methanamine
CID 117174896
2-[(2-methoxyphenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117257564

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine?
The IUPAC name of 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine (CID 117191477) is 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine.
What is the SMILES notation for 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine?
The canonical SMILES for 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine is COc1ccccc1OCc1cn(C)c(N)n1.
What is the InChIKey of 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine?
The InChIKey is KLOFWCRSHLASBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-15-7-9(14-12(15)13)8-17-11-6-4-3-5-10(11)16-2/h3-7H,8H2,1-2H3,(H2,13,14).
What are the key properties of 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine?
4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine has a molecular weight of 233.27 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenoxy)methyl]-1-methylimidazol-2-amine is sourced from PubChem (CID 117191477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).