7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde

C13H15N3O — CID 83893652

IUPAC7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2cc(N3CCCCC3)ccn12
InChIInChI=1S/C13H15N3O/c17-10-12-9-14-13-8-11(4-7-16(12)13)15-5-2-1-3-6-15/h4,7-10H,1-3,5-6H2
InChIKeyMHFVDPBKHAKFKL-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.14
Rot. Bonds2

About 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde

7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 83893652) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID83893652
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2cc(N3CCCCC3)ccn12
InChIInChI=1S/C13H15N3O/c17-10-12-9-14-13-8-11(4-7-16(12)13)15-5-2-1-3-6-15/h4,7-10H,1-3,5-6H2
InChIKeyMHFVDPBKHAKFKL-UHFFFAOYSA-N
XLogP2.14
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.14
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 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde (CID 83893652) is 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1cnc2cc(N3CCCCC3)ccn12.
What is the InChIKey of 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is MHFVDPBKHAKFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c17-10-12-9-14-13-8-11(4-7-16(12)13)15-5-2-1-3-6-15/h4,7-10H,1-3,5-6H2.
What are the key properties of 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 229.28 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 83893652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).