6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine

C12H17N3O — CID 143987462

IUPAC6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine
SMILESCOC1=C(n2cnc(C)c2)C=CC(C)N1C
InChIInChI=1S/C12H17N3O/c1-9-7-15(8-13-9)11-6-5-10(2)14(3)12(11)16-4/h5-8,10H,1-4H3
InChIKeyPQFZCEZCEHLWFX-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.85
Rot. Bonds2

About 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine

6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine (PubChem CID 143987462) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine.

Molecular Properties

Compound Name6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine
PubChem CID143987462
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine
SMILESCOC1=C(n2cnc(C)c2)C=CC(C)N1C
InChIInChI=1S/C12H17N3O/c1-9-7-15(8-13-9)11-6-5-10(2)14(3)12(11)16-4/h5-8,10H,1-4H3
InChIKeyPQFZCEZCEHLWFX-UHFFFAOYSA-N
XLogP1.85
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethenyl-6-methoxy-1-methyl-5-(4-methylimidazol-1-yl)-2H-pyridine
CID 148813178
O-[5-methoxy-6-methyl-4-(4-methylimidazol-1-yl)cyclohexa-2,4-dien-1-yl]hydroxylamine
CID 91474179
1-(2-methoxy-4-propan-2-ylcyclohexa-1,5-dien-1-yl)-4-methylimidazole
CID 163419103
4-methyl-1-(3,4,5-trimethoxyphenyl)imidazole
CID 147782659
3-methoxy-2-(4-methylimidazol-1-yl)pyridine
CID 141128975
4-methoxy-N-methyl-5-(4-methylimidazol-1-yl)pyridin-2-amine
CID 169237582
4-methoxy-2-(4-methylimidazol-1-yl)-3-nitrosopyridine
CID 89069885
4-methyl-2-(4-methylimidazol-1-yl)pyrimidine
CID 21025903
[4-chloro-5-methoxy-2-(4-methylimidazol-1-yl)phenyl]-methoxyazanium
CID 143812515
ethane;3-methoxy-4-(4-methylimidazol-1-yl)aniline
CID 144841192
1-(2-iodophenyl)-4-methylimidazole
CID 152683666
1,4-dimethylimidazole;hydrochloride
CID 146623882

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine?
The IUPAC name of 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine (CID 143987462) is 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine.
What is the SMILES notation for 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine?
The canonical SMILES for 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine is COC1=C(n2cnc(C)c2)C=CC(C)N1C.
What is the InChIKey of 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine?
The InChIKey is PQFZCEZCEHLWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-9-7-15(8-13-9)11-6-5-10(2)14(3)12(11)16-4/h5-8,10H,1-4H3.
What are the key properties of 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine?
6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine has a molecular weight of 219.29 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,2-dimethyl-5-(4-methylimidazol-1-yl)-2H-pyridine is sourced from PubChem (CID 143987462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).