[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine

C11H13N3O — CID 43649243

IUPAC[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine
SMILESCOc1ccccc1-c1cnc(CN)[nH]1
InChIInChI=1S/C11H13N3O/c1-15-10-5-3-2-4-8(10)9-7-13-11(6-12)14-9/h2-5,7H,6,12H2,1H3,(H,13,14)
InChIKeyVIAMQLXTHMQEBW-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.54
Rot. Bonds3

About [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine

[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine (PubChem CID 43649243) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine
PubChem CID43649243
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine
SMILESCOc1ccccc1-c1cnc(CN)[nH]1
InChIInChI=1S/C11H13N3O/c1-15-10-5-3-2-4-8(10)9-7-13-11(6-12)14-9/h2-5,7H,6,12H2,1H3,(H,13,14)
InChIKeyVIAMQLXTHMQEBW-UHFFFAOYSA-N
XLogP1.54
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine?
The IUPAC name of [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine (CID 43649243) is [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine.
What is the SMILES notation for [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine?
The canonical SMILES for [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine is COc1ccccc1-c1cnc(CN)[nH]1.
What is the InChIKey of [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine?
The InChIKey is VIAMQLXTHMQEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-15-10-5-3-2-4-8(10)9-7-13-11(6-12)14-9/h2-5,7H,6,12H2,1H3,(H,13,14).
What are the key properties of [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine?
[5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine has a molecular weight of 203.24 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methoxyphenyl)-1H-imidazol-2-yl]methanamine is sourced from PubChem (CID 43649243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).