3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde

C13H15N3O — CID 83893665

IUPAC3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCc1nc(C=O)c2cc(N3CCCC3)ccn12
InChIInChI=1S/C13H15N3O/c1-10-14-12(9-17)13-8-11(4-7-16(10)13)15-5-2-3-6-15/h4,7-9H,2-3,5-6H2,1H3
InChIKeyDTRHGJZZLDWSCT-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.06
Rot. Bonds2

About 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde

3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 83893665) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID83893665
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCc1nc(C=O)c2cc(N3CCCC3)ccn12
InChIInChI=1S/C13H15N3O/c1-10-14-12(9-17)13-8-11(4-7-16(10)13)15-5-2-3-6-15/h4,7-9H,2-3,5-6H2,1H3
InChIKeyDTRHGJZZLDWSCT-UHFFFAOYSA-N
XLogP2.06
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 ≤ 52.06
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-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridin-3-amine
CID 83887277
7-piperidin-1-ylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 83893652
2-methyl-4-pyrrolidin-1-ylbenzaldehyde
CID 958834
ethyl 7-pyrrolidin-1-ylimidazo[1,2-a]pyridine-3-carboxylate
CID 145001485
1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one
CID 168514090
1-methyl-7-morpholin-4-ylimidazo[1,5-a]pyridin-3-amine
CID 83895232
1-formyl-3-(2-methylpropyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 84741781
1-methyl-6-pyrrolidin-1-ylindazole
CID 123532355
7-bromo-3-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84744943
2-(2-methyl-5-pyrrolidin-1-ylbenzimidazol-1-yl)acetic acid
CID 83972340
2-chloro-4-pyrrolidin-1-ylbenzaldehyde
CID 7148620
4-(4-fluorophenyl)-2-methyl-6-piperidin-1-ylquinoline-3-carbaldehyde
CID 143782236

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde (CID 83893665) is 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde is Cc1nc(C=O)c2cc(N3CCCC3)ccn12.
What is the InChIKey of 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is DTRHGJZZLDWSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10-14-12(9-17)13-8-11(4-7-16(10)13)15-5-2-3-6-15/h4,7-9H,2-3,5-6H2,1H3.
What are the key properties of 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde?
3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 229.28 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-pyrrolidin-1-ylimidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 83893665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).