7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine

C13H14N2 — CID 91153531

IUPAC7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine
SMILESC=C(c1ccn2c(C)cnc2c1)C1CC1
InChIInChI=1S/C13H14N2/c1-9-8-14-13-7-12(5-6-15(9)13)10(2)11-3-4-11/h5-8,11H,2-4H2,1H3
InChIKeyIXRCNKXIAXNFFQ-UHFFFAOYSA-N
MW198.27 g/mol
LogP3.07
Rot. Bonds2

About 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine

7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine (PubChem CID 91153531) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine
PubChem CID91153531
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine
SMILESC=C(c1ccn2c(C)cnc2c1)C1CC1
InChIInChI=1S/C13H14N2/c1-9-8-14-13-7-12(5-6-15(9)13)10(2)11-3-4-11/h5-8,11H,2-4H2,1H3
InChIKeyIXRCNKXIAXNFFQ-UHFFFAOYSA-N
XLogP3.07
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine?
The IUPAC name of 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine (CID 91153531) is 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine is C=C(c1ccn2c(C)cnc2c1)C1CC1.
What is the InChIKey of 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine?
The InChIKey is IXRCNKXIAXNFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-9-8-14-13-7-12(5-6-15(9)13)10(2)11-3-4-11/h5-8,11H,2-4H2,1H3.
What are the key properties of 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine?
7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine has a molecular weight of 198.27 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-cyclopropylethenyl)-3-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 91153531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).