3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde

C15H19N3O — CID 117145932

IUPAC3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
SMILESCC(C)N1CCC(c2ncc3c(C=O)cccn23)C1
InChIInChI=1S/C15H19N3O/c1-11(2)17-7-5-12(9-17)15-16-8-14-13(10-19)4-3-6-18(14)15/h3-4,6,8,10-12H,5,7,9H2,1-2H3
InChIKeyUYPHCHIBDWNUQU-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.34
Rot. Bonds3

About 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde

3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde (PubChem CID 117145932) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde.

Molecular Properties

Compound Name3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
PubChem CID117145932
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
SMILESCC(C)N1CCC(c2ncc3c(C=O)cccn23)C1
InChIInChI=1S/C15H19N3O/c1-11(2)17-7-5-12(9-17)15-16-8-14-13(10-19)4-3-6-18(14)15/h3-4,6,8,10-12H,5,7,9H2,1-2H3
InChIKeyUYPHCHIBDWNUQU-UHFFFAOYSA-N
XLogP2.34
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(1-propan-2-ylpiperidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117145988
3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117145945
3-piperidin-4-ylimidazo[1,5-a]pyridine-8-carbaldehyde
CID 117145941
3-(1-propan-2-ylpiperidin-4-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147415
3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117146015
3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117250358
8-methyl-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117146223
3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147381
1-chloro-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-7-ol
CID 117251610
3-(1-propan-2-ylpyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117148268
8-chloro-3-[(1-propan-2-ylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
CID 117146357
6-methyl-3-(1-propan-2-ylpyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117148270

Frequently Asked Questions

What is the IUPAC name of 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde?
The IUPAC name of 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde (CID 117145932) is 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde.
What is the SMILES notation for 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde?
The canonical SMILES for 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde is CC(C)N1CCC(c2ncc3c(C=O)cccn23)C1.
What is the InChIKey of 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde?
The InChIKey is UYPHCHIBDWNUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11(2)17-7-5-12(9-17)15-16-8-14-13(10-19)4-3-6-18(14)15/h3-4,6,8,10-12H,5,7,9H2,1-2H3.
What are the key properties of 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde?
3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde has a molecular weight of 257.34 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carbaldehyde is sourced from PubChem (CID 117145932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).