2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol

C11H13N3O — CID 83129951

IUPAC2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol
SMILESCCn1ccnc1Cc1ncccc1O
InChIInChI=1S/C11H13N3O/c1-2-14-7-6-13-11(14)8-9-10(15)4-3-5-12-9/h3-7,15H,2,8H2,1H3
InChIKeyWIPUTBJJKRPSBH-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.59
Rot. Bonds3

About 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol

2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol (PubChem CID 83129951) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol.

Molecular Properties

Compound Name2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol
PubChem CID83129951
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol
SMILESCCn1ccnc1Cc1ncccc1O
InChIInChI=1S/C11H13N3O/c1-2-14-7-6-13-11(14)8-9-10(15)4-3-5-12-9/h3-7,15H,2,8H2,1H3
InChIKeyWIPUTBJJKRPSBH-UHFFFAOYSA-N
XLogP1.59
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol?
The IUPAC name of 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol (CID 83129951) is 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol.
What is the SMILES notation for 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol?
The canonical SMILES for 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol is CCn1ccnc1Cc1ncccc1O.
What is the InChIKey of 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol?
The InChIKey is WIPUTBJJKRPSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-2-14-7-6-13-11(14)8-9-10(15)4-3-5-12-9/h3-7,15H,2,8H2,1H3.
What are the key properties of 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol?
2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol has a molecular weight of 203.25 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylimidazol-2-yl)methyl]pyridin-3-ol is sourced from PubChem (CID 83129951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).