1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde

C8H10N2O — CID 150067898

IUPAC1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde
SMILESO=CC1CN2CC=CC=C2N1
InChIInChI=1S/C8H10N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-3,6-7,9H,4-5H2
InChIKeyDOQSLWRCIAYBEF-UHFFFAOYSA-N
MW150.18 g/mol
LogP-0.13
Rot. Bonds1

About 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde

1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde (PubChem CID 150067898) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde
PubChem CID150067898
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde
SMILESO=CC1CN2CC=CC=C2N1
InChIInChI=1S/C8H10N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-3,6-7,9H,4-5H2
InChIKeyDOQSLWRCIAYBEF-UHFFFAOYSA-N
XLogP-0.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde?
The IUPAC name of 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde (CID 150067898) is 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde.
What is the SMILES notation for 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde?
The canonical SMILES for 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde is O=CC1CN2CC=CC=C2N1.
What is the InChIKey of 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde?
The InChIKey is DOQSLWRCIAYBEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-3,6-7,9H,4-5H2.
What are the key properties of 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde?
1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde has a molecular weight of 150.18 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-2-carbaldehyde is sourced from PubChem (CID 150067898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).