8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine

C25H27N5 — CID 167658582

IUPAC8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine
SMILESCc1cc(N2CCC(CCc3nccn4c(-c5ccccc5)cnc34)CC2)ccn1
InChIInChI=1S/C25H27N5/c1-19-17-22(9-12-26-19)29-14-10-20(11-15-29)7-8-23-25-28-18-24(30(25)16-13-27-23)21-5-3-2-4-6-21/h2-6,9,12-13,16-18,20H,7-8,10-11,14-15H2,1H3
InChIKeyXNHNAISQIUCJQG-UHFFFAOYSA-N
MW397.53 g/mol
LogP4.95
Rot. Bonds5

About 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine

8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine (PubChem CID 167658582) has the molecular formula C25H27N5 and a molecular weight of 397.53 g/mol. Its IUPAC name is 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine
PubChem CID167658582
Molecular FormulaC25H27N5
Molecular Weight397.53 g/mol
Exact Mass397.23
IUPAC Name8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine
SMILESCc1cc(N2CCC(CCc3nccn4c(-c5ccccc5)cnc34)CC2)ccn1
InChIInChI=1S/C25H27N5/c1-19-17-22(9-12-26-19)29-14-10-20(11-15-29)7-8-23-25-28-18-24(30(25)16-13-27-23)21-5-3-2-4-6-21/h2-6,9,12-13,16-18,20H,7-8,10-11,14-15H2,1H3
InChIKeyXNHNAISQIUCJQG-UHFFFAOYSA-N
XLogP4.95
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.53
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methylcarbamic acid
CID 22052415
2-methyl-4-[4-(2-phenylethoxy)piperidin-1-yl]pyridine
CID 133464611
4-benzyl-5-methyl-1-(2-methyl-4-pyridinyl)-1,4-diazepane
CID 133491985
2-[[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methyl]-6-pyridin-4-ylpyridazin-3-one
CID 126863499
4-chloro-1-(2-methyl-4-pyridinyl)azepane
CID 131020856
2-methyl-4-(3-pyrazol-1-ylpyrrolidin-1-yl)pyridine
CID 126946437
1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
CID 163317288
N,N-dimethyl-3-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]imidazol-1-yl]propan-1-amine
CID 72919298
N-[[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methyl]pyrazine-2-carboxamide
CID 131927095
4-(4-benzylpiperidin-1-yl)-2-chloropyridine
CID 102824003
1-(2-methyl-6-phenyl-4-pyridinyl)piperidin-4-ol
CID 143206385
2-[4-(5-phenylimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]ethanol
CID 126473750

Frequently Asked Questions

What is the IUPAC name of 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine?
The IUPAC name of 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine (CID 167658582) is 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine?
The canonical SMILES for 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine is Cc1cc(N2CCC(CCc3nccn4c(-c5ccccc5)cnc34)CC2)ccn1.
What is the InChIKey of 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine?
The InChIKey is XNHNAISQIUCJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N5/c1-19-17-22(9-12-26-19)29-14-10-20(11-15-29)7-8-23-25-28-18-24(30(25)16-13-27-23)21-5-3-2-4-6-21/h2-6,9,12-13,16-18,20H,7-8,10-11,14-15H2,1H3.
What are the key properties of 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine?
8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine has a molecular weight of 397.53 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 167658582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).