methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate

C16H21N3O2 — CID 117134360

IUPACmethyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate
SMILESCCN1CCCCC1c1cn2ccc(C(=O)OC)cc2n1
InChIInChI=1S/C16H21N3O2/c1-3-18-8-5-4-6-14(18)13-11-19-9-7-12(16(20)21-2)10-15(19)17-13/h7,9-11,14H,3-6,8H2,1-2H3
InChIKeyGPLJTOCZCRWHOY-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.67
Rot. Bonds3

About methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate

methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate (PubChem CID 117134360) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate
PubChem CID117134360
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Namemethyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate
SMILESCCN1CCCCC1c1cn2ccc(C(=O)OC)cc2n1
InChIInChI=1S/C16H21N3O2/c1-3-18-8-5-4-6-14(18)13-11-19-9-7-12(16(20)21-2)10-15(19)17-13/h7,9-11,14H,3-6,8H2,1-2H3
InChIKeyGPLJTOCZCRWHOY-UHFFFAOYSA-N
XLogP2.67
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117134358
7-chloro-2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine
CID 117134326
methyl 2-(1-ethylpyrrolidin-2-yl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117136523
methyl 2-piperidin-3-ylimidazo[1,2-a]pyridine-7-carboxylate
CID 117134090
2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridin-6-ol
CID 117129694
methyl 2-[(1-propan-2-ylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridine-7-carboxylate
CID 117133970
methyl 2-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-7-carboxylate
CID 117256424
methyl 2-[2-(4-methylpiperazin-1-yl)ethyl]imidazo[1,2-a]pyridine-7-carboxylate
CID 117135564
methyl 2-(1-methylpiperidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117134357
2-(1-ethylpiperidin-4-yl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117133711
methyl 2-(3-methoxypropyl)imidazo[1,2-a]pyridine-7-carboxylate
CID 117133420
2-cyclohexylimidazo[1,2-a]pyridine-7-carboxylic acid
CID 82357034

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate?
The IUPAC name of methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate (CID 117134360) is methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate.
What is the SMILES notation for methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate?
The canonical SMILES for methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate is CCN1CCCCC1c1cn2ccc(C(=O)OC)cc2n1.
What is the InChIKey of methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate?
The InChIKey is GPLJTOCZCRWHOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-3-18-8-5-4-6-14(18)13-11-19-9-7-12(16(20)21-2)10-15(19)17-13/h7,9-11,14H,3-6,8H2,1-2H3.
What are the key properties of methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate?
methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate has a molecular weight of 287.36 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylate is sourced from PubChem (CID 117134360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).