3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine

C12H14N4 — CID 139515213

IUPAC3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine
SMILESCc1cn(C2=CN3C(=NCC3C)C=C2)cn1
InChIInChI=1S/C12H14N4/c1-9-6-15(8-14-9)11-3-4-12-13-5-10(2)16(12)7-11/h3-4,6-8,10H,5H2,1-2H3
InChIKeyHJKPCBJYCAXCPR-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.66
Rot. Bonds1

About 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine

3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine (PubChem CID 139515213) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine
PubChem CID139515213
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine
SMILESCc1cn(C2=CN3C(=NCC3C)C=C2)cn1
InChIInChI=1S/C12H14N4/c1-9-6-15(8-14-9)11-3-4-12-13-5-10(2)16(12)7-11/h3-4,6-8,10H,5H2,1-2H3
InChIKeyHJKPCBJYCAXCPR-UHFFFAOYSA-N
XLogP1.66
TPSA33.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine (CID 139515213) is 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine is Cc1cn(C2=CN3C(=NCC3C)C=C2)cn1.
What is the InChIKey of 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine?
The InChIKey is HJKPCBJYCAXCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-9-6-15(8-14-9)11-3-4-12-13-5-10(2)16(12)7-11/h3-4,6-8,10H,5H2,1-2H3.
What are the key properties of 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine?
3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine has a molecular weight of 214.27 g/mol, XLogP of 1.66, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(4-methylimidazol-1-yl)-2,3-dihydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 139515213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).