2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone

C10H10N2O2 — CID 43463677

IUPAC2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone
SMILESCc1ccoc1C(=O)Cc1ncc[nH]1
InChIInChI=1S/C10H10N2O2/c1-7-2-5-14-10(7)8(13)6-9-11-3-4-12-9/h2-5H,6H2,1H3,(H,11,12)
InChIKeyRHFCNDGEHHKECF-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.74
Rot. Bonds3

About 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone

2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone (PubChem CID 43463677) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone
PubChem CID43463677
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone
SMILESCc1ccoc1C(=O)Cc1ncc[nH]1
InChIInChI=1S/C10H10N2O2/c1-7-2-5-14-10(7)8(13)6-9-11-3-4-12-9/h2-5H,6H2,1H3,(H,11,12)
InChIKeyRHFCNDGEHHKECF-UHFFFAOYSA-N
XLogP1.74
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone?
The IUPAC name of 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone (CID 43463677) is 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone?
The canonical SMILES for 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone is Cc1ccoc1C(=O)Cc1ncc[nH]1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone?
The InChIKey is RHFCNDGEHHKECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-7-2-5-14-10(7)8(13)6-9-11-3-4-12-9/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone?
2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone has a molecular weight of 190.20 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-1-(3-methylfuran-2-yl)ethanone is sourced from PubChem (CID 43463677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).