8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine

C27H25N5 — CID 167575410

IUPAC8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine
SMILESCc1cc(-c2ncc(C(C)Cc3nccn4c(-c5ccccc5)cnc34)cc2C)ccn1
InChIInChI=1S/C27H25N5/c1-18(23-13-19(2)26(30-16-23)22-9-10-28-20(3)15-22)14-24-27-31-17-25(32(27)12-11-29-24)21-7-5-4-6-8-21/h4-13,15-18H,14H2,1-3H3
InChIKeyYGDBOYYWVOYPDU-UHFFFAOYSA-N
MW419.53 g/mol
LogP5.82
Rot. Bonds5

About 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine

8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine (PubChem CID 167575410) has the molecular formula C27H25N5 and a molecular weight of 419.53 g/mol. Its IUPAC name is 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine
PubChem CID167575410
Molecular FormulaC27H25N5
Molecular Weight419.53 g/mol
Exact Mass419.21
IUPAC Name8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine
SMILESCc1cc(-c2ncc(C(C)Cc3nccn4c(-c5ccccc5)cnc34)cc2C)ccn1
InChIInChI=1S/C27H25N5/c1-18(23-13-19(2)26(30-16-23)22-9-10-28-20(3)15-22)14-24-27-31-17-25(32(27)12-11-29-24)21-7-5-4-6-8-21/h4-13,15-18H,14H2,1-3H3
InChIKeyYGDBOYYWVOYPDU-UHFFFAOYSA-N
XLogP5.82
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.53
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methyl-4-pyridinyl)-5-[2-(3-phenylimidazo[1,2-a]pyrazin-8-yl)ethyl]benzonitrile
CID 167580832
3-[3-(difluoromethyl)phenyl]-8-[2-[5-methyl-6-(3-methylphenyl)-3-pyridinyl]ethyl]imidazo[1,2-a]pyrazine
CID 167582834
2-[[5-[2-[3-(3,5-difluorophenyl)imidazo[1,2-a]pyrazin-8-yl]ethyl]-2-(3-methylphenyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine;3-(3,5-difluorophenyl)-8-[2-[6-(3-methylphenyl)-5-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]ethyl]imidazo[1,2-a]pyrazine;2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-3-(3-phenylimidazo[1,2-a]pyrazin-8-yl)propan-1-ol
CID 167704630
8-[2-[1-(2-methyl-4-pyridinyl)piperidin-4-yl]ethyl]-3-phenylimidazo[1,2-a]pyrazine
CID 167658582
1-[4-[8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]ethyl]imidazo[1,2-a]pyrazin-3-yl]piperidin-1-yl]ethanone
CID 167546877
methyl 8-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methylamino]imidazo[1,2-a]pyrazine-3-carboxylate
CID 155478844
5-[[[3-(3,5-difluorophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]-2-(2-methyl-4-pyridinyl)pyridin-3-ol
CID 155478922
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 149174065
8-[2-[5-methyl-6-(3-methylphenyl)-3-pyridinyl]ethyl]-3-(1-propan-2-ylpiperidin-4-yl)imidazo[1,2-a]pyrazine
CID 167647671
N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-3-piperidin-4-ylimidazo[1,2-a]pyrazin-8-amine
CID 155478426
3-methyl-8-(2-methylpropyl)imidazo[1,2-a]pyrazine
CID 154971222
8-(2-methyl-4-pyridinyl)-7-phenylimidazo[1,2-c]pyrimidin-5-amine;2,2,2-trifluoroacetic acid
CID 139508781

Frequently Asked Questions

What is the IUPAC name of 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine?
The IUPAC name of 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine (CID 167575410) is 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine?
The canonical SMILES for 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine is Cc1cc(-c2ncc(C(C)Cc3nccn4c(-c5ccccc5)cnc34)cc2C)ccn1.
What is the InChIKey of 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine?
The InChIKey is YGDBOYYWVOYPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25N5/c1-18(23-13-19(2)26(30-16-23)22-9-10-28-20(3)15-22)14-24-27-31-17-25(32(27)12-11-29-24)21-7-5-4-6-8-21/h4-13,15-18H,14H2,1-3H3.
What are the key properties of 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine?
8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine has a molecular weight of 419.53 g/mol, XLogP of 5.82, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propyl]-3-phenylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 167575410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).