5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol

C14H13N3O — CID 4107560

IUPAC5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol
SMILESCc1nccn1Cc1ccc(O)c2ncccc12
InChIInChI=1S/C14H13N3O/c1-10-15-7-8-17(10)9-11-4-5-13(18)14-12(11)3-2-6-16-14/h2-8,18H,9H2,1H3
InChIKeyCQTFYUCZBPGPIS-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.49
Rot. Bonds2

About 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol

5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol (PubChem CID 4107560) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol.

Molecular Properties

Compound Name5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol
PubChem CID4107560
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol
SMILESCc1nccn1Cc1ccc(O)c2ncccc12
InChIInChI=1S/C14H13N3O/c1-10-15-7-8-17(10)9-11-4-5-13(18)14-12(11)3-2-6-16-14/h2-8,18H,9H2,1H3
InChIKeyCQTFYUCZBPGPIS-UHFFFAOYSA-N
XLogP2.49
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol 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 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol?
The IUPAC name of 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol (CID 4107560) is 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol.
What is the SMILES notation for 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol?
The canonical SMILES for 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol is Cc1nccn1Cc1ccc(O)c2ncccc12.
What is the InChIKey of 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol?
The InChIKey is CQTFYUCZBPGPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-10-15-7-8-17(10)9-11-4-5-13(18)14-12(11)3-2-6-16-14/h2-8,18H,9H2,1H3.
What are the key properties of 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol?
5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol has a molecular weight of 239.28 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylimidazol-1-yl)methyl]quinolin-8-ol is sourced from PubChem (CID 4107560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).