methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate

C14H17N3O2 — CID 117136001

IUPACmethyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate
SMILESCOC(=O)c1cccn2cc(C3CCNCC3)nc12
InChIInChI=1S/C14H17N3O2/c1-19-14(18)11-3-2-8-17-9-12(16-13(11)17)10-4-6-15-7-5-10/h2-3,8-10,15H,4-7H2,1H3
InChIKeyDNSACVXUSRGJQH-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.59
Rot. Bonds2

About methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate

methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate (PubChem CID 117136001) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate.

Molecular Properties

Compound Namemethyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate
PubChem CID117136001
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Namemethyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate
SMILESCOC(=O)c1cccn2cc(C3CCNCC3)nc12
InChIInChI=1S/C14H17N3O2/c1-19-14(18)11-3-2-8-17-9-12(16-13(11)17)10-4-6-15-7-5-10/h2-3,8-10,15H,4-7H2,1H3
InChIKeyDNSACVXUSRGJQH-UHFFFAOYSA-N
XLogP1.59
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(thiolan-3-yl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117135873
methyl 2-(1-ethylpyrrolidin-2-yl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117136523
methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117137725
methyl 2-thiophen-2-ylimidazo[1,2-a]pyridine-8-carboxylate
CID 117137140
8-chloro-2-pyrrolidin-3-ylimidazo[1,2-a]pyridine
CID 105478712
2-cyclopropylimidazo[1,2-a]pyridin-8-ol
CID 117137728
methyl 2-(4-piperidin-4-ylphenyl)indazole-7-carboxylate
CID 44550352
methyl 2-(2-piperidin-1-ylethyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117137830
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 117256766
2-cyclopentylimidazo[1,2-a]pyridin-8-ol
CID 117137747
methyl 4-[(6-piperidin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methyl]benzoate
CID 118148213
methyl 2-piperidin-3-ylimidazo[1,2-a]pyridine-7-carboxylate
CID 117134090

Frequently Asked Questions

What is the IUPAC name of methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate?
The IUPAC name of methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate (CID 117136001) is methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate.
What is the SMILES notation for methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate?
The canonical SMILES for methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate is COC(=O)c1cccn2cc(C3CCNCC3)nc12.
What is the InChIKey of methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate?
The InChIKey is DNSACVXUSRGJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-19-14(18)11-3-2-8-17-9-12(16-13(11)17)10-4-6-15-7-5-10/h2-3,8-10,15H,4-7H2,1H3.
What are the key properties of methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate?
methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate has a molecular weight of 259.31 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate is sourced from PubChem (CID 117136001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).