[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol

C10H11N3O — CID 63108335

IUPAC[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(Cc2ccccn2)[nH]1
InChIInChI=1S/C10H11N3O/c14-7-9-6-12-10(13-9)5-8-3-1-2-4-11-8/h1-4,6,14H,5,7H2,(H,12,13)
InChIKeyIRXHTOCDQRGTPP-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.89
Rot. Bonds3

About [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol

[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol (PubChem CID 63108335) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol
PubChem CID63108335
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(Cc2ccccn2)[nH]1
InChIInChI=1S/C10H11N3O/c14-7-9-6-12-10(13-9)5-8-3-1-2-4-11-8/h1-4,6,14H,5,7H2,(H,12,13)
InChIKeyIRXHTOCDQRGTPP-UHFFFAOYSA-N
XLogP0.89
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol (CID 63108335) is [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol is OCc1cnc(Cc2ccccn2)[nH]1.
What is the InChIKey of [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol?
The InChIKey is IRXHTOCDQRGTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-7-9-6-12-10(13-9)5-8-3-1-2-4-11-8/h1-4,6,14H,5,7H2,(H,12,13).
What are the key properties of [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol?
[2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol has a molecular weight of 189.22 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(pyridin-2-ylmethyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 63108335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).