3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine

C8H12N2 — CID 140571721

IUPAC3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine
SMILESCC1CNC2C=CC=CN12
InChIInChI=1S/C8H12N2/c1-7-6-9-8-4-2-3-5-10(7)8/h2-5,7-9H,6H2,1H3
InChIKeyBIWISCONMNYEEZ-UHFFFAOYSA-N
MW136.20 g/mol
LogP0.69
Rot. Bonds

About 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine

3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 140571721) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine
PubChem CID140571721
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine
SMILESCC1CNC2C=CC=CN12
InChIInChI=1S/C8H12N2/c1-7-6-9-8-4-2-3-5-10(7)8/h2-5,7-9H,6H2,1H3
InChIKeyBIWISCONMNYEEZ-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine (CID 140571721) is 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine is CC1CNC2C=CC=CN12.
What is the InChIKey of 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is BIWISCONMNYEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-7-6-9-8-4-2-3-5-10(7)8/h2-5,7-9H,6H2,1H3.
What are the key properties of 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine?
3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 136.20 g/mol, XLogP of 0.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,2,3,8a-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 140571721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).