[5-(3-methylimidazol-4-yl)furan-2-yl]methanol

C9H10N2O2 — CID 126971966

IUPAC[5-(3-methylimidazol-4-yl)furan-2-yl]methanol
SMILESCn1cncc1-c1ccc(CO)o1
InChIInChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9-3-2-7(5-12)13-9/h2-4,6,12H,5H2,1H3
InChIKeyAWIBLXGTJCVBCQ-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.17
Rot. Bonds2

About [5-(3-methylimidazol-4-yl)furan-2-yl]methanol

[5-(3-methylimidazol-4-yl)furan-2-yl]methanol (PubChem CID 126971966) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is [5-(3-methylimidazol-4-yl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(3-methylimidazol-4-yl)furan-2-yl]methanol
PubChem CID126971966
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name[5-(3-methylimidazol-4-yl)furan-2-yl]methanol
SMILESCn1cncc1-c1ccc(CO)o1
InChIInChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9-3-2-7(5-12)13-9/h2-4,6,12H,5H2,1H3
InChIKeyAWIBLXGTJCVBCQ-UHFFFAOYSA-N
XLogP1.17
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 ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(3-methylimidazol-4-yl)-1,3-thiazol-4-yl]ethanol
CID 130512447
5-(bromomethyl)-3-(3-methylimidazol-4-yl)-1,2-oxazole
CID 66117288
[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 82668626
1-methyl-5-(2-phenylphenyl)imidazole
CID 50949205
[5-(4-ethylphenyl)furan-2-yl]methanol
CID 60894732
[5-(3-methyl-2-pyridinyl)furan-2-yl]methanol
CID 15081314
N-[[5-(3-methylimidazol-4-yl)-1,2,4-oxadiazol-3-yl]methyl]ethanamine
CID 103511959
[5-(3-amino-4-methylphenyl)furan-2-yl]methanol
CID 2987173
azane;(5-methylfuran-2-yl)methanol
CID 175565780
[5-(1-phenylindazol-3-yl)furan-2-yl]methanol
CID 10039848
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide
CID 28675230
5-(2-iodophenyl)-1-methylimidazole
CID 46846743

Frequently Asked Questions

What is the IUPAC name of [5-(3-methylimidazol-4-yl)furan-2-yl]methanol?
The IUPAC name of [5-(3-methylimidazol-4-yl)furan-2-yl]methanol (CID 126971966) is [5-(3-methylimidazol-4-yl)furan-2-yl]methanol.
What is the SMILES notation for [5-(3-methylimidazol-4-yl)furan-2-yl]methanol?
The canonical SMILES for [5-(3-methylimidazol-4-yl)furan-2-yl]methanol is Cn1cncc1-c1ccc(CO)o1.
What is the InChIKey of [5-(3-methylimidazol-4-yl)furan-2-yl]methanol?
The InChIKey is AWIBLXGTJCVBCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-11-6-10-4-8(11)9-3-2-7(5-12)13-9/h2-4,6,12H,5H2,1H3.
What are the key properties of [5-(3-methylimidazol-4-yl)furan-2-yl]methanol?
[5-(3-methylimidazol-4-yl)furan-2-yl]methanol has a molecular weight of 178.19 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-methylimidazol-4-yl)furan-2-yl]methanol is sourced from PubChem (CID 126971966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).