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

C12H11N3O — CID 63108798

IUPAC[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine
SMILESNCc1cnc(-c2cc3ccccc3o2)[nH]1
InChIInChI=1S/C12H11N3O/c13-6-9-7-14-12(15-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7H,6,13H2,(H,14,15)
InChIKeyRZUIAHJZUAPIJO-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.28
Rot. Bonds2

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

[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine (PubChem CID 63108798) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine
PubChem CID63108798
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine
SMILESNCc1cnc(-c2cc3ccccc3o2)[nH]1
InChIInChI=1S/C12H11N3O/c13-6-9-7-14-12(15-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7H,6,13H2,(H,14,15)
InChIKeyRZUIAHJZUAPIJO-UHFFFAOYSA-N
XLogP2.28
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-benzofuran-2-yl)-5-bromo-1H-pyrimidin-6-one
CID 66316989
(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine
CID 63222608
2,5-bis(1-benzofuran-2-yl)pyrazine
CID 86184221
2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine
CID 82388761
2-(1-benzofuran-2-yl)-6-(methoxymethyl)-1H-pyrimidine-4-thione
CID 106477762
2-[4-(1-benzofuran-2-yl)phenyl]ethanamine
CID 110282118
6-(1-benzofuran-2-yl)-2H-triazolo[4,5-b]pyridine
CID 119058904
[2-(4-fluorophenyl)-1H-imidazol-5-yl]methanamine
CID 63108865
3-(1-benzofuran-2-yl)pyrazin-2-amine
CID 114734408
2-(1-benzofuran-2-yl)-N-[(2,4-dioxo-1,3-diazaspiro[4.4]nonan-8-yl)methyl]-1H-imidazole-5-sulfinamide
CID 177036723
2-(1-benzofuran-2-yl)-5-ethyl-4-hydroxy-1H-pyrimidin-6-one
CID 63613792
[3-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenyl]methanamine
CID 20983781

Frequently Asked Questions

What is the IUPAC name of [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine?
The IUPAC name of [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine (CID 63108798) is [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine.
What is the SMILES notation for [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine?
The canonical SMILES for [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine is NCc1cnc(-c2cc3ccccc3o2)[nH]1.
What is the InChIKey of [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine?
The InChIKey is RZUIAHJZUAPIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c13-6-9-7-14-12(15-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7H,6,13H2,(H,14,15).
What are the key properties of [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine?
[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine has a molecular weight of 213.24 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine is sourced from PubChem (CID 63108798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).