6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde

C9H12N2O — CID 83826757

IUPAC6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCC1CCc2c(C=O)ncn2C1
InChIInChI=1S/C9H12N2O/c1-7-2-3-9-8(5-12)10-6-11(9)4-7/h5-7H,2-4H2,1H3
InChIKeyFAEBACICKFUJNH-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.28
Rot. Bonds1

About 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde

6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 83826757) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID83826757
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCC1CCc2c(C=O)ncn2C1
InChIInChI=1S/C9H12N2O/c1-7-2-3-9-8(5-12)10-6-11(9)4-7/h5-7H,2-4H2,1H3
InChIKeyFAEBACICKFUJNH-UHFFFAOYSA-N
XLogP1.28
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.28
H-Bond Donors ≤ 50
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 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde (CID 83826757) is 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde is CC1CCc2c(C=O)ncn2C1.
What is the InChIKey of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is FAEBACICKFUJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-7-2-3-9-8(5-12)10-6-11(9)4-7/h5-7H,2-4H2,1H3.
What are the key properties of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde?
6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 164.21 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 83826757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).