7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde

C13H17N3O — CID 83894885

IUPAC7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCC(C)c1nc(C=O)c2cc(N(C)C)ccn12
InChIInChI=1S/C13H17N3O/c1-9(2)13-14-11(8-17)12-7-10(15(3)4)5-6-16(12)13/h5-9H,1-4H3
InChIKeyIAMBMUVXQFSEMY-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.34
Rot. Bonds3

About 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde

7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 83894885) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID83894885
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCC(C)c1nc(C=O)c2cc(N(C)C)ccn12
InChIInChI=1S/C13H17N3O/c1-9(2)13-14-11(8-17)12-7-10(15(3)4)5-6-16(12)13/h5-9H,1-4H3
InChIKeyIAMBMUVXQFSEMY-UHFFFAOYSA-N
XLogP2.34
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
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

1-formyl-3-propan-2-ylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740930
3-(4-bromophenyl)-7-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745253
3-(3-bromophenyl)-7-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745254
7-(dimethylamino)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 83877126
6-methoxy-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84740196
1-chloro-7-(dimethylamino)imidazo[1,5-a]pyridine-3-carboxylic acid
CID 83898591
1-bromo-7-N,7-N-dimethylimidazo[1,5-a]pyridine-3,7-diamine
CID 83901116
7-methyl-1,3-di(propan-2-yl)imidazo[1,5-a]pyridine
CID 134295360
7-methyl-3-(methylaminomethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84739779
3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84740202
1-formyl-3-(2-methylpropyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 84741781
3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carbaldehyde
CID 82404564

Frequently Asked Questions

What is the IUPAC name of 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde (CID 83894885) is 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde is CC(C)c1nc(C=O)c2cc(N(C)C)ccn12.
What is the InChIKey of 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is IAMBMUVXQFSEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-9(2)13-14-11(8-17)12-7-10(15(3)4)5-6-16(12)13/h5-9H,1-4H3.
What are the key properties of 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 231.30 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 7-(dimethylamino)-3-propan-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 83894885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).