3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde

C16H21N3O — CID 117143521

IUPAC3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde
SMILESCCN1CCC(Cc2ncc3cc(C=O)ccn23)CC1
InChIInChI=1S/C16H21N3O/c1-2-18-6-3-13(4-7-18)10-16-17-11-15-9-14(12-20)5-8-19(15)16/h5,8-9,11-13H,2-4,6-7,10H2,1H3
InChIKeyCVJVCUKGWWECEQ-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.42
Rot. Bonds4

About 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde

3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde (PubChem CID 117143521) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde.

Molecular Properties

Compound Name3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde
PubChem CID117143521
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde
SMILESCCN1CCC(Cc2ncc3cc(C=O)ccn23)CC1
InChIInChI=1S/C16H21N3O/c1-2-18-6-3-13(4-7-18)10-16-17-11-15-9-14(12-20)5-8-19(15)16/h5,8-9,11-13H,2-4,6-7,10H2,1H3
InChIKeyCVJVCUKGWWECEQ-UHFFFAOYSA-N
XLogP2.42
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143247
7-chloro-3-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
CID 117143904
2-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117133885
3-(1-ethylpyrrolidin-2-yl)imidazo[1,5-a]pyridine-7-carbaldehyde
CID 117143549
3-cyclopropylimidazo[1,5-a]pyridine-7-carbaldehyde
CID 83828916
3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-7-carbaldehyde
CID 117143490
3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde
CID 83831720
3-[(1-ethylpiperidin-4-yl)methyl]-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117151255
7-methoxy-3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridine
CID 117142954
3-[(1-ethylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carbaldehyde
CID 117138555
7-bromo-3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyridine
CID 84743877
7-methyl-3-(oxan-3-ylmethyl)imidazo[1,5-a]pyridine
CID 117144279

Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde?
The IUPAC name of 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde (CID 117143521) is 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde.
What is the SMILES notation for 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde?
The canonical SMILES for 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde is CCN1CCC(Cc2ncc3cc(C=O)ccn23)CC1.
What is the InChIKey of 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde?
The InChIKey is CVJVCUKGWWECEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-18-6-3-13(4-7-18)10-16-17-11-15-9-14(12-20)5-8-19(15)16/h5,8-9,11-13H,2-4,6-7,10H2,1H3.
What are the key properties of 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde?
3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde has a molecular weight of 271.36 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,5-a]pyridine-7-carbaldehyde is sourced from PubChem (CID 117143521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).