tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate

C24H28N8O3 — CID 164945336

IUPACtert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(C#N)(CNc2nc(-c3ccncc3)cn3cc(C(N)=O)nc23)CC1
InChIInChI=1S/C24H28N8O3/c1-23(2,3)35-22(34)31-10-6-24(14-25,7-11-31)15-28-20-21-30-18(19(26)33)13-32(21)12-17(29-20)16-4-8-27-9-5-16/h4-5,8-9,12-13H,6-7,10-11,15H2,1-3H3,(H2,26,33)(H,28,29)
InChIKeyCYSLHQHCGZDQQL-UHFFFAOYSA-N
MW476.54 g/mol
LogP2.84
Rot. Bonds5

About tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate

tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate (PubChem CID 164945336) has the molecular formula C24H28N8O3 and a molecular weight of 476.54 g/mol. Its IUPAC name is tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate
PubChem CID164945336
Molecular FormulaC24H28N8O3
Molecular Weight476.54 g/mol
Exact Mass476.23
IUPAC Nametert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(C#N)(CNc2nc(-c3ccncc3)cn3cc(C(N)=O)nc23)CC1
InChIInChI=1S/C24H28N8O3/c1-23(2,3)35-22(34)31-10-6-24(14-25,7-11-31)15-28-20-21-30-18(19(26)33)13-32(21)12-17(29-20)16-4-8-27-9-5-16/h4-5,8-9,12-13H,6-7,10-11,15H2,1-3H3,(H2,26,33)(H,28,29)
InChIKeyCYSLHQHCGZDQQL-UHFFFAOYSA-N
XLogP2.84
TPSA151.53 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.54
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-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

tert-butyl 4-[2-[[2-carbamoyl-6-(2-chloro-4-pyridinyl)imidazo[1,2-a]pyrazin-8-yl]amino]ethyl]-4-cyanopiperidine-1-carboxylate
CID 164945308
ethyl 6-(2-chloro-4-pyridinyl)-8-[[4-cyano-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]imidazo[1,2-a]pyrazine-2-carboxylate
CID 164945388
tert-butyl 4-[[[2-carbamoyl-6-(3-fluoro-4-pyridinyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]-4-fluoropiperidine-1-carboxylate
CID 164945397
tert-butyl 4-[[[2-(2-methoxyethylcarbamoyl)-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl]amino]methyl]piperidine-1-carboxylate
CID 164945363
ethyl 8-[[4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]-3-methyl-6-pyridin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
CID 164945368
ethyl 6-(3-fluoro-4-pyridinyl)-8-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]imidazo[1,2-a]pyrazine-2-carboxylate
CID 164945339
ethyl 8-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]-6-pyridin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
CID 164908494
ethyl 6-(2-chloro-4-pyridinyl)-8-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]methylamino]imidazo[1,2-a]pyrazine-2-carboxylate
CID 164945384
ethyl 8-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]amino]-6-pyridin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
CID 164945307
tert-butyl 4-[4-carbamoyl-3-(pyridin-4-ylamino)pyrazol-1-yl]-4-(cyanomethyl)piperidine-1-carboxylate
CID 71536781
tert-butyl 3-cyano-3-pyridin-4-ylpyrrolidine-1-carboxylate
CID 22236898
8-[(4-cyanopiperidin-4-yl)methylamino]-N-(2-methoxyethyl)-3-methyl-6-pyridin-4-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 164945334

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate (CID 164945336) is tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(C#N)(CNc2nc(-c3ccncc3)cn3cc(C(N)=O)nc23)CC1.
What is the InChIKey of tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate?
The InChIKey is CYSLHQHCGZDQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N8O3/c1-23(2,3)35-22(34)31-10-6-24(14-25,7-11-31)15-28-20-21-30-18(19(26)33)13-32(21)12-17(29-20)16-4-8-27-9-5-16/h4-5,8-9,12-13H,6-7,10-11,15H2,1-3H3,(H2,26,33)(H,28,29).
What are the key properties of tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate?
tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate has a molecular weight of 476.54 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[[(2-carbamoyl-6-pyridin-4-ylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]-4-cyanopiperidine-1-carboxylate is sourced from PubChem (CID 164945336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).