4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid

C26H24N6O2 — CID 154942724

IUPAC4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid
SMILESCc1cn2c(-c3ccnc4ccccc34)cnc2cc1-c1cnn(C2CCN(C(=O)O)CC2)c1
InChIInChI=1S/C26H24N6O2/c1-17-15-31-24(21-6-9-27-23-5-3-2-4-20(21)23)14-28-25(31)12-22(17)18-13-29-32(16-18)19-7-10-30(11-8-19)26(33)34/h2-6,9,12-16,19H,7-8,10-11H2,1H3,(H,33,34)
InChIKeyIFMJNUIAPJVYRH-UHFFFAOYSA-N
MW452.52 g/mol
LogP5.04
Rot. Bonds3

About 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid

4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid (PubChem CID 154942724) has the molecular formula C26H24N6O2 and a molecular weight of 452.52 g/mol. Its IUPAC name is 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid
PubChem CID154942724
Molecular FormulaC26H24N6O2
Molecular Weight452.52 g/mol
Exact Mass452.20
IUPAC Name4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid
SMILESCc1cn2c(-c3ccnc4ccccc34)cnc2cc1-c1cnn(C2CCN(C(=O)O)CC2)c1
InChIInChI=1S/C26H24N6O2/c1-17-15-31-24(21-6-9-27-23-5-3-2-4-20(21)23)14-28-25(31)12-22(17)18-13-29-32(16-18)19-7-10-30(11-8-19)26(33)34/h2-6,9,12-16,19H,7-8,10-11H2,1H3,(H,33,34)
InChIKeyIFMJNUIAPJVYRH-UHFFFAOYSA-N
XLogP5.04
TPSA88.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.52
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid with MolForge

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Related Compounds

4-[4-[6-methyl-3-(7-pyridin-4-ylquinolin-4-yl)imidazo[1,2-b]pyridazin-7-yl]pyrazol-1-yl]cyclohexan-1-ol
CID 146889195
1-[4-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperazin-1-yl]ethanone
CID 139326849
2,6-dimethyl-4-[1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrazol-4-yl]benzoic acid
CID 172876934
4-(4-bromopyrazol-1-yl)piperidine-1-carboxylic acid
CID 67027237
4-[4-[6-amino-5-(1,3-benzothiazol-2-yl)-3-pyridinyl]pyrazol-1-yl]-N,N-dimethylpiperidine-1-carboxamide
CID 67520316
2-fluoro-5-methyl-4-[1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrazol-4-yl]benzoic acid
CID 171906130
4-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-8-(trifluoromethyl)quinoline
CID 171679495
4-chloro-7-methoxy-6-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]quinoline
CID 171679503
4-(1-cyclopentylpyrazol-4-yl)-2-fluoro-6-methylbenzoic acid
CID 171365273
2,6-dimethyl-4-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]morpholine
CID 142306273
5-[6-methyl-7-[1-(oxan-4-yl)pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl]-2-(4-methyltriazol-2-yl)-1,8-naphthyridine
CID 152619700
1-[4-[4-(2-chloropyrimidin-5-yl)pyrazol-1-yl]piperidin-1-yl]ethanone
CID 178082262

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid?
The IUPAC name of 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid (CID 154942724) is 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid.
What is the SMILES notation for 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid?
The canonical SMILES for 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid is Cc1cn2c(-c3ccnc4ccccc34)cnc2cc1-c1cnn(C2CCN(C(=O)O)CC2)c1.
What is the InChIKey of 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid?
The InChIKey is IFMJNUIAPJVYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6O2/c1-17-15-31-24(21-6-9-27-23-5-3-2-4-20(21)23)14-28-25(31)12-22(17)18-13-29-32(16-18)19-7-10-30(11-8-19)26(33)34/h2-6,9,12-16,19H,7-8,10-11H2,1H3,(H,33,34).
What are the key properties of 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid?
4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid has a molecular weight of 452.52 g/mol, XLogP of 5.04, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-methyl-3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)pyrazol-1-yl]piperidine-1-carboxylic acid is sourced from PubChem (CID 154942724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).