6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine

C9H11N3 — CID 123461813

IUPAC6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine
SMILESCN1CC=CC=C1c1ncc[nH]1
InChIInChI=1S/C9H11N3/c1-12-7-3-2-4-8(12)9-10-5-6-11-9/h2-6H,7H2,1H3,(H,10,11)
InChIKeySYEQSNZMVNHGNA-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.25
Rot. Bonds1

About 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine

6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine (PubChem CID 123461813) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine.

Molecular Properties

Compound Name6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine
PubChem CID123461813
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine
SMILESCN1CC=CC=C1c1ncc[nH]1
InChIInChI=1S/C9H11N3/c1-12-7-3-2-4-8(12)9-10-5-6-11-9/h2-6H,7H2,1H3,(H,10,11)
InChIKeySYEQSNZMVNHGNA-UHFFFAOYSA-N
XLogP1.25
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine?
The IUPAC name of 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine (CID 123461813) is 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine.
What is the SMILES notation for 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine?
The canonical SMILES for 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine is CN1CC=CC=C1c1ncc[nH]1.
What is the InChIKey of 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine?
The InChIKey is SYEQSNZMVNHGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-12-7-3-2-4-8(12)9-10-5-6-11-9/h2-6H,7H2,1H3,(H,10,11).
What are the key properties of 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine?
6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine has a molecular weight of 161.21 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-imidazol-2-yl)-1-methyl-2H-pyridine is sourced from PubChem (CID 123461813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).