4-[(2-methylimidazol-1-yl)methyl]pyridine

C10H11N3 — CID 52949342

IUPAC4-[(2-methylimidazol-1-yl)methyl]pyridine
SMILESCc1nccn1Cc1ccncc1
InChIInChI=1S/C10H11N3/c1-9-12-6-7-13(9)8-10-2-4-11-5-3-10/h2-7H,8H2,1H3
InChIKeyMNSNMTASPOHKEI-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.63
Rot. Bonds2

About 4-[(2-methylimidazol-1-yl)methyl]pyridine

4-[(2-methylimidazol-1-yl)methyl]pyridine (PubChem CID 52949342) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 4-[(2-methylimidazol-1-yl)methyl]pyridine.

Molecular Properties

Compound Name4-[(2-methylimidazol-1-yl)methyl]pyridine
PubChem CID52949342
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name4-[(2-methylimidazol-1-yl)methyl]pyridine
SMILESCc1nccn1Cc1ccncc1
InChIInChI=1S/C10H11N3/c1-9-12-6-7-13(9)8-10-2-4-11-5-3-10/h2-7H,8H2,1H3
InChIKeyMNSNMTASPOHKEI-UHFFFAOYSA-N
XLogP1.63
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[(2-methylimidazol-1-yl)methyl]pyridine 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 4-[(2-methylimidazol-1-yl)methyl]pyridine?
The IUPAC name of 4-[(2-methylimidazol-1-yl)methyl]pyridine (CID 52949342) is 4-[(2-methylimidazol-1-yl)methyl]pyridine.
What is the SMILES notation for 4-[(2-methylimidazol-1-yl)methyl]pyridine?
The canonical SMILES for 4-[(2-methylimidazol-1-yl)methyl]pyridine is Cc1nccn1Cc1ccncc1.
What is the InChIKey of 4-[(2-methylimidazol-1-yl)methyl]pyridine?
The InChIKey is MNSNMTASPOHKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-9-12-6-7-13(9)8-10-2-4-11-5-3-10/h2-7H,8H2,1H3.
What are the key properties of 4-[(2-methylimidazol-1-yl)methyl]pyridine?
4-[(2-methylimidazol-1-yl)methyl]pyridine has a molecular weight of 173.22 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylimidazol-1-yl)methyl]pyridine is sourced from PubChem (CID 52949342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).