2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde

C15H19N3O — CID 117136566

IUPAC2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde
SMILESCCN1CCCCC1c1cn2cccc(C=O)c2n1
InChIInChI=1S/C15H19N3O/c1-2-17-8-4-3-7-14(17)13-10-18-9-5-6-12(11-19)15(18)16-13/h5-6,9-11,14H,2-4,7-8H2,1H3
InChIKeyNFVSBNYGBCGGPW-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.69
Rot. Bonds3

About 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde

2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde (PubChem CID 117136566) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde.

Molecular Properties

Compound Name2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde
PubChem CID117136566
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde
SMILESCCN1CCCCC1c1cn2cccc(C=O)c2n1
InChIInChI=1S/C15H19N3O/c1-2-17-8-4-3-7-14(17)13-10-18-9-5-6-12(11-19)15(18)16-13/h5-6,9-11,14H,2-4,7-8H2,1H3
InChIKeyNFVSBNYGBCGGPW-UHFFFAOYSA-N
XLogP2.69
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 ≤ 52.69
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

2-(1-ethylpiperidin-2-yl)-8-methylimidazo[1,2-a]pyridine
CID 117136613
2-(1-ethylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-8-ol
CID 117136486
methyl 2-(1-ethylpyrrolidin-2-yl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117136523
2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde
CID 84732789
3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117146015
7-chloro-2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine
CID 117134326
2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117134358
2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridin-6-ol
CID 117129694
8-bromo-2-(1-methylpiperidin-2-yl)imidazo[1,2-a]pyridine
CID 117136602
8-chloro-2-(1-methylpiperidin-2-yl)imidazo[1,2-a]pyridine
CID 117136601
methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate
CID 117134360
2-[(1,1-dioxothian-2-yl)methyl]imidazo[1,2-a]pyridine-8-carbaldehyde
CID 117136819

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde?
The IUPAC name of 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde (CID 117136566) is 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde.
What is the SMILES notation for 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde?
The canonical SMILES for 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde is CCN1CCCCC1c1cn2cccc(C=O)c2n1.
What is the InChIKey of 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde?
The InChIKey is NFVSBNYGBCGGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-2-17-8-4-3-7-14(17)13-10-18-9-5-6-12(11-19)15(18)16-13/h5-6,9-11,14H,2-4,7-8H2,1H3.
What are the key properties of 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde?
2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde has a molecular weight of 257.34 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-8-carbaldehyde is sourced from PubChem (CID 117136566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).