[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol

C11H12FN3O — CID 105383215

IUPAC[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol
SMILESCCc1nccn1-c1nccc(CO)c1F
InChIInChI=1S/C11H12FN3O/c1-2-9-13-5-6-15(9)11-10(12)8(7-16)3-4-14-11/h3-6,16H,2,7H2,1H3
InChIKeyNGPKRYLTFTXSSD-UHFFFAOYSA-N
MW221.24 g/mol
LogP1.46
Rot. Bonds3

About [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol

[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol (PubChem CID 105383215) has the molecular formula C11H12FN3O and a molecular weight of 221.24 g/mol. Its IUPAC name is [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol
PubChem CID105383215
Molecular FormulaC11H12FN3O
Molecular Weight221.24 g/mol
Exact Mass221.10
IUPAC Name[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol
SMILESCCc1nccn1-c1nccc(CO)c1F
InChIInChI=1S/C11H12FN3O/c1-2-9-13-5-6-15(9)11-10(12)8(7-16)3-4-14-11/h3-6,16H,2,7H2,1H3
InChIKeyNGPKRYLTFTXSSD-UHFFFAOYSA-N
XLogP1.46
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The IUPAC name of [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol (CID 105383215) is [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol.
What is the SMILES notation for [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The canonical SMILES for [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol is CCc1nccn1-c1nccc(CO)c1F.
What is the InChIKey of [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
The InChIKey is NGPKRYLTFTXSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-2-9-13-5-6-15(9)11-10(12)8(7-16)3-4-14-11/h3-6,16H,2,7H2,1H3.
What are the key properties of [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol?
[2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol has a molecular weight of 221.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethylimidazol-1-yl)-3-fluoro-4-pyridinyl]methanol is sourced from PubChem (CID 105383215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).