ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate

C25H27N5O2 — CID 135240865

IUPACethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2cccc3ncc(-c4ccc(-c5cnn(C)c5)cc4)n23)CC1
InChIInChI=1S/C25H27N5O2/c1-3-32-25(31)20-11-13-29(14-12-20)24-6-4-5-23-26-16-22(30(23)24)19-9-7-18(8-10-19)21-15-27-28(2)17-21/h4-10,15-17,20H,3,11-14H2,1-2H3
InChIKeyJZPPSUJFUITLTQ-UHFFFAOYSA-N
MW429.52 g/mol
LogP4.18
Rot. Bonds5

About ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate

ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate (PubChem CID 135240865) has the molecular formula C25H27N5O2 and a molecular weight of 429.52 g/mol. Its IUPAC name is ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate
PubChem CID135240865
Molecular FormulaC25H27N5O2
Molecular Weight429.52 g/mol
Exact Mass429.22
IUPAC Nameethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate
SMILESCCOC(=O)C1CCN(c2cccc3ncc(-c4ccc(-c5cnn(C)c5)cc4)n23)CC1
InChIInChI=1S/C25H27N5O2/c1-3-32-25(31)20-11-13-29(14-12-20)24-6-4-5-23-26-16-22(30(23)24)19-9-7-18(8-10-19)21-15-27-28(2)17-21/h4-10,15-17,20H,3,11-14H2,1-2H3
InChIKeyJZPPSUJFUITLTQ-UHFFFAOYSA-N
XLogP4.18
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.52
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 4-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]cyclohex-3-ene-1-carboxylate
CID 135249439
8-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]-2,8-diazaspiro[4.5]decan-1-one
CID 135260537
1-[1-[3-[2-(1-methylpyrazol-4-yl)ethynyl]imidazo[1,2-a]pyridin-5-yl]piperidin-4-yl]ethanone
CID 135249413
1-[4-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 135249544
ethyl 1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidine-4-carboxylate
CID 115372977
ethane;ethyl 1-(5-methylpyrimidin-2-yl)piperidine-4-carboxylate
CID 143917578
ethyl 1-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperidine-4-carboxylate
CID 30756005
ethyl 1-[6-(4-methylphenoxy)pyrimidin-4-yl]piperidine-4-carboxylate
CID 42806339
(2-cyanophenyl)methyl 1-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]piperidine-4-carboxylate
CID 177117950
ethyl 1-(3-aminophenyl)piperidine-4-carboxylate
CID 22060555
ethyl 1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidine-4-carboxylate
CID 66334132
ethyl 1-(4-amino-2-pyridinyl)piperidine-4-carboxylate
CID 68568819

Frequently Asked Questions

What is the IUPAC name of ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate?
The IUPAC name of ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate (CID 135240865) is ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate.
What is the SMILES notation for ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate?
The canonical SMILES for ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate is CCOC(=O)C1CCN(c2cccc3ncc(-c4ccc(-c5cnn(C)c5)cc4)n23)CC1.
What is the InChIKey of ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate?
The InChIKey is JZPPSUJFUITLTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N5O2/c1-3-32-25(31)20-11-13-29(14-12-20)24-6-4-5-23-26-16-22(30(23)24)19-9-7-18(8-10-19)21-15-27-28(2)17-21/h4-10,15-17,20H,3,11-14H2,1-2H3.
What are the key properties of ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate?
ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate has a molecular weight of 429.52 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-[3-[4-(1-methylpyrazol-4-yl)phenyl]imidazo[1,2-a]pyridin-5-yl]piperidine-4-carboxylate is sourced from PubChem (CID 135240865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).