ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate

C16H19N3O3 — CID 87051265

IUPACethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(C(=O)c2cn3ccccc3n2)CC1
InChIInChI=1S/C16H19N3O3/c1-2-22-16(21)12-6-9-18(10-7-12)15(20)13-11-19-8-4-3-5-14(19)17-13/h3-5,8,11-12H,2,6-7,9-10H2,1H3
InChIKeyWEYXCWKGJXZMLE-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.75
Rot. Bonds3

About ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate

ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate (PubChem CID 87051265) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate
PubChem CID87051265
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Nameethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(C(=O)c2cn3ccccc3n2)CC1
InChIInChI=1S/C16H19N3O3/c1-2-22-16(21)12-6-9-18(10-7-12)15(20)13-11-19-8-4-3-5-14(19)17-13/h3-5,8,11-12H,2,6-7,9-10H2,1H3
InChIKeyWEYXCWKGJXZMLE-UHFFFAOYSA-N
XLogP1.75
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidine-4-carboxylate
CID 53171810
2-[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-4-yl]acetic acid
CID 79612699
ethyl 1-(6-bromopyridine-2-carbonyl)piperidine-4-carboxylate
CID 103874990
ethyl 1-(6-methoxypyridine-2-carbonyl)piperidine-4-carboxylate
CID 84580551
1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 43355877
[4-(2,5-dimethylphenyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-ylmethanone
CID 87051259
ethyl 1-(2-amino-1,3-thiazole-4-carbonyl)piperidine-4-carboxylate
CID 62788546
ethyl 1-[2-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carbonyl]piperidine-4-carboxylate
CID 134799350
ethyl 1-[2-(1-amino-2-phenylethyl)-1,3-oxazole-4-carbonyl]piperidine-4-carboxylate
CID 3865870
cyclopropyl imidazo[1,2-a]pyridine-2-carboxylate
CID 165133317
ethyl 1-[2-tert-butyl-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate
CID 42877225
ethyl 1-(6-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)piperidine-4-carboxylate
CID 4775673

Frequently Asked Questions

What is the IUPAC name of ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate?
The IUPAC name of ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate (CID 87051265) is ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate.
What is the SMILES notation for ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate?
The canonical SMILES for ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate is CCOC(=O)C1CCN(C(=O)c2cn3ccccc3n2)CC1.
What is the InChIKey of ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate?
The InChIKey is WEYXCWKGJXZMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-2-22-16(21)12-6-9-18(10-7-12)15(20)13-11-19-8-4-3-5-14(19)17-13/h3-5,8,11-12H,2,6-7,9-10H2,1H3.
What are the key properties of ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate?
ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate has a molecular weight of 301.35 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate is sourced from PubChem (CID 87051265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).