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

C9H11N3O — CID 103386742

IUPAC[5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine
SMILESCc1cnc(-c2ccc(CN)o2)[nH]1
InChIInChI=1S/C9H11N3O/c1-6-5-11-9(12-6)8-3-2-7(4-10)13-8/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyXFEIEBFUWMIDFS-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.44
Rot. Bonds2

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

[5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine (PubChem CID 103386742) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine
PubChem CID103386742
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name[5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine
SMILESCc1cnc(-c2ccc(CN)o2)[nH]1
InChIInChI=1S/C9H11N3O/c1-6-5-11-9(12-6)8-3-2-7(4-10)13-8/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyXFEIEBFUWMIDFS-UHFFFAOYSA-N
XLogP1.44
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[5-[5-(3,4-difluorophenyl)-1H-imidazol-2-yl]furan-2-yl]methanamine
CID 103386793
[5-(4-ethyl-5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine
CID 103386758
[5-(5-methyl-4-phenyl-1H-imidazol-2-yl)furan-2-yl]methanamine
CID 103386822
[5-(1,5-dimethylpyrazol-4-yl)furan-2-yl]methanamine
CID 106888910
[6-(5-methyl-1H-imidazol-2-yl)pyrazin-2-yl]methanamine
CID 82404542
[5-(3-methylphenyl)furan-2-yl]methanamine
CID 28804201
2-(4-tert-butylphenyl)-5-methyl-1H-imidazole
CID 44512575
(5-pyridin-4-ylfuran-2-yl)methanamine
CID 72716677
5-(5-methyl-1H-imidazol-2-yl)-1H-pyrazol-4-amine
CID 143500421
ethane;5-methyl-2-phenyl-1H-imidazole
CID 145236732
2-chloro-5-(5-methyl-1H-imidazol-2-yl)aniline
CID 82470505
[2-(5-ethylfuran-2-yl)-1,3-thiazol-5-yl]methanamine
CID 62347401

Frequently Asked Questions

What is the IUPAC name of [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine?
The IUPAC name of [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine (CID 103386742) is [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine.
What is the SMILES notation for [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine?
The canonical SMILES for [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine is Cc1cnc(-c2ccc(CN)o2)[nH]1.
What is the InChIKey of [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine?
The InChIKey is XFEIEBFUWMIDFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-6-5-11-9(12-6)8-3-2-7(4-10)13-8/h2-3,5H,4,10H2,1H3,(H,11,12).
What are the key properties of [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine?
[5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine has a molecular weight of 177.21 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(5-methyl-1H-imidazol-2-yl)furan-2-yl]methanamine is sourced from PubChem (CID 103386742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).