(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone

C10H9BrN2O2 — CID 130519243

IUPAC(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone
SMILESCc1ncc(C(=O)c2ccc(Br)o2)n1C
InChIInChI=1S/C10H9BrN2O2/c1-6-12-5-7(13(6)2)10(14)8-3-4-9(11)15-8/h3-5H,1-2H3
InChIKeyBFHQFDORRONCEQ-UHFFFAOYSA-N
MW269.10 g/mol
LogP2.32
Rot. Bonds2

About (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone

(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone (PubChem CID 130519243) has the molecular formula C10H9BrN2O2 and a molecular weight of 269.10 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone
PubChem CID130519243
Molecular FormulaC10H9BrN2O2
Molecular Weight269.10 g/mol
Exact Mass267.98
IUPAC Name(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone
SMILESCc1ncc(C(=O)c2ccc(Br)o2)n1C
InChIInChI=1S/C10H9BrN2O2/c1-6-12-5-7(13(6)2)10(14)8-3-4-9(11)15-8/h3-5H,1-2H3
InChIKeyBFHQFDORRONCEQ-UHFFFAOYSA-N
XLogP2.32
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.10
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1-Butylimidazol-2-yl)-(5-methylfuran-2-yl)methanone
CID 124140345
5-(Furan-2-ylcarbonyl)imidazole-1-sulfonic acid dimethylamide
CID 20711782
Furan-2-yl-(3-methylimidazol-4-yl)methanone
CID 59037616
furan-2-yl(1H-imidazol-5-yl)methanone
CID 69925007
5-(Furan-2-carbonyl)imidazole-1-sulfonic acid
CID 22598404
1-(5-bromofuran-2-yl)-2-(1H-imidazol-2-yl)ethanone
CID 43463682
(5-Bromofuran-2-yl)-(1-methylimidazol-2-yl)methanone
CID 60659890
(5-Methylfuran-2-yl)-(1-methylimidazol-2-yl)methanone
CID 60660105
(5-Bromofuran-2-yl)-(1-propylimidazol-2-yl)methanone
CID 61314204
(5-Bromofuran-2-yl)-(1-ethylimidazol-2-yl)methanone
CID 61314573
(5-Methylfuran-2-yl)-(1-propylimidazol-2-yl)methanone
CID 61314952
(1-Ethylimidazol-2-yl)-(5-methylfuran-2-yl)methanone
CID 61315324

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone?
The IUPAC name of (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone (CID 130519243) is (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone.
What is the SMILES notation for (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone?
The canonical SMILES for (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone is Cc1ncc(C(=O)c2ccc(Br)o2)n1C.
What is the InChIKey of (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone?
The InChIKey is BFHQFDORRONCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O2/c1-6-12-5-7(13(6)2)10(14)8-3-4-9(11)15-8/h3-5H,1-2H3.
What are the key properties of (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone?
(5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone has a molecular weight of 269.10 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(2,3-dimethylimidazol-4-yl)methanone is sourced from PubChem (CID 130519243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).