N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine

C20H17FN4O2 — CID 59473196

IUPACN-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3ccc(F)cc3)cn3ccnc23)cc1OC
InChIInChI=1S/C20H17FN4O2/c1-26-17-8-7-15(11-18(17)27-2)23-19-20-22-9-10-25(20)12-16(24-19)13-3-5-14(21)6-4-13/h3-12H,1-2H3,(H,23,24)
InChIKeyBTWSJHWAOWJULA-UHFFFAOYSA-N
MW364.38 g/mol
LogP4.30
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine

N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 59473196) has the molecular formula C20H17FN4O2 and a molecular weight of 364.38 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID59473196
Molecular FormulaC20H17FN4O2
Molecular Weight364.38 g/mol
Exact Mass364.13
IUPAC NameN-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3ccc(F)cc3)cn3ccnc23)cc1OC
InChIInChI=1S/C20H17FN4O2/c1-26-17-8-7-15(11-18(17)27-2)23-19-20-22-9-10-25(20)12-16(24-19)13-3-5-14(21)6-4-13/h3-12H,1-2H3,(H,23,24)
InChIKeyBTWSJHWAOWJULA-UHFFFAOYSA-N
XLogP4.30
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine (CID 59473196) is N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine is COc1ccc(Nc2nc(-c3ccc(F)cc3)cn3ccnc23)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is BTWSJHWAOWJULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN4O2/c1-26-17-8-7-15(11-18(17)27-2)23-19-20-22-9-10-25(20)12-16(24-19)13-3-5-14(21)6-4-13/h3-12H,1-2H3,(H,23,24).
What are the key properties of N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 364.38 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 59473196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).