4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid

C16H21N3O2 — CID 114426519

IUPAC4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid
SMILESCc1ccc2nc(CN3CCC(C)CC3C(=O)O)cn2c1
InChIInChI=1S/C16H21N3O2/c1-11-5-6-18(14(7-11)16(20)21)9-13-10-19-8-12(2)3-4-15(19)17-13/h3-4,8,10-11,14H,5-7,9H2,1-2H3,(H,20,21)
InChIKeyGJXAIURXTJRMMK-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.33
Rot. Bonds3

About 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid

4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid (PubChem CID 114426519) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid
PubChem CID114426519
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid
SMILESCc1ccc2nc(CN3CCC(C)CC3C(=O)O)cn2c1
InChIInChI=1S/C16H21N3O2/c1-11-5-6-18(14(7-11)16(20)21)9-13-10-19-8-12(2)3-4-15(19)17-13/h3-4,8,10-11,14H,5-7,9H2,1-2H3,(H,20,21)
InChIKeyGJXAIURXTJRMMK-UHFFFAOYSA-N
XLogP2.33
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-4-methylpiperidine-2-carboxylic acid
CID 114426395
1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-oxopiperazine-2-carboxylic acid
CID 107439791
methyl 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylate
CID 78915575
4-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-2-carboxylic acid
CID 114426836
2-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazin-1-yl]acetic acid
CID 43521725
1-[(3,5-dimethylphenyl)methyl]-4-methylpiperidine-2-carboxylic acid
CID 114426307
1-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylic acid
CID 43441956
4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-ol
CID 103897964
1-benzyl-4-methylpiperidine-2-carboxylic acid;4-methylbenzenesulfonic acid
CID 86735354
1-[2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetyl]pyrrolidine-2-carboxylic acid
CID 119355795
4-methyl-1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxylic acid
CID 114426304
1-[(2,5-dichlorophenyl)methyl]-4-methylpiperidine-2-carboxylic acid
CID 114426468

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid?
The IUPAC name of 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid (CID 114426519) is 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid.
What is the SMILES notation for 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid?
The canonical SMILES for 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid is Cc1ccc2nc(CN3CCC(C)CC3C(=O)O)cn2c1.
What is the InChIKey of 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid?
The InChIKey is GJXAIURXTJRMMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11-5-6-18(14(7-11)16(20)21)9-13-10-19-8-12(2)3-4-15(19)17-13/h3-4,8,10-11,14H,5-7,9H2,1-2H3,(H,20,21).
What are the key properties of 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid?
4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid has a molecular weight of 287.36 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 114426519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).