furan-3-yl-(3-methylimidazol-4-yl)methanol

C9H10N2O2 — CID 66119030

IUPACfuran-3-yl-(3-methylimidazol-4-yl)methanol
SMILESCn1cncc1C(O)c1ccoc1
InChIInChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9(12)7-2-3-13-5-7/h2-6,9,12H,1H3
InChIKeyZMMDUWMHLYHMGZ-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.09
Rot. Bonds2

About furan-3-yl-(3-methylimidazol-4-yl)methanol

furan-3-yl-(3-methylimidazol-4-yl)methanol (PubChem CID 66119030) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is furan-3-yl-(3-methylimidazol-4-yl)methanol.

Molecular Properties

Compound Namefuran-3-yl-(3-methylimidazol-4-yl)methanol
PubChem CID66119030
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Namefuran-3-yl-(3-methylimidazol-4-yl)methanol
SMILESCn1cncc1C(O)c1ccoc1
InChIInChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9(12)7-2-3-13-5-7/h2-6,9,12H,1H3
InChIKeyZMMDUWMHLYHMGZ-UHFFFAOYSA-N
XLogP1.09
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(3-methylimidazol-4-yl)methanol?
The IUPAC name of furan-3-yl-(3-methylimidazol-4-yl)methanol (CID 66119030) is furan-3-yl-(3-methylimidazol-4-yl)methanol.
What is the SMILES notation for furan-3-yl-(3-methylimidazol-4-yl)methanol?
The canonical SMILES for furan-3-yl-(3-methylimidazol-4-yl)methanol is Cn1cncc1C(O)c1ccoc1.
What is the InChIKey of furan-3-yl-(3-methylimidazol-4-yl)methanol?
The InChIKey is ZMMDUWMHLYHMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9(12)7-2-3-13-5-7/h2-6,9,12H,1H3.
What are the key properties of furan-3-yl-(3-methylimidazol-4-yl)methanol?
furan-3-yl-(3-methylimidazol-4-yl)methanol has a molecular weight of 178.19 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(3-methylimidazol-4-yl)methanol is sourced from PubChem (CID 66119030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).