4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde

C15H14N2O2 — CID 82381406

IUPAC4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde
SMILESCc1ccn2c(-c3cc(C=O)oc3C)c(C)nc2c1
InChIInChI=1S/C15H14N2O2/c1-9-4-5-17-14(6-9)16-10(2)15(17)13-7-12(8-18)19-11(13)3/h4-8H,1-3H3
InChIKeyTUMUPGMHTHUWGG-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.33
Rot. Bonds2

About 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde

4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde (PubChem CID 82381406) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde.

Molecular Properties

Compound Name4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde
PubChem CID82381406
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde
SMILESCc1ccn2c(-c3cc(C=O)oc3C)c(C)nc2c1
InChIInChI=1S/C15H14N2O2/c1-9-4-5-17-14(6-9)16-10(2)15(17)13-7-12(8-18)19-11(13)3/h4-8H,1-3H3
InChIKeyTUMUPGMHTHUWGG-UHFFFAOYSA-N
XLogP3.33
TPSA47.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde?
The IUPAC name of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde (CID 82381406) is 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde.
What is the SMILES notation for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde?
The canonical SMILES for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde is Cc1ccn2c(-c3cc(C=O)oc3C)c(C)nc2c1.
What is the InChIKey of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde?
The InChIKey is TUMUPGMHTHUWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-9-4-5-17-14(6-9)16-10(2)15(17)13-7-12(8-18)19-11(13)3/h4-8H,1-3H3.
What are the key properties of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde?
4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde has a molecular weight of 254.29 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-5-methylfuran-2-carbaldehyde is sourced from PubChem (CID 82381406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).