3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine

C22H16N4O2 — CID 44538803

IUPAC3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2c(-c3ccoc3)nc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C22H16N4O2/c23-21-20-19(25-22(16-10-13-27-14-16)26(20)12-11-24-21)15-6-8-18(9-7-15)28-17-4-2-1-3-5-17/h1-14H,(H2,23,24)
InChIKeyTUGZHCPNPTWOOK-UHFFFAOYSA-N
MW368.40 g/mol
LogP5.03
Rot. Bonds4

About 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine

3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 44538803) has the molecular formula C22H16N4O2 and a molecular weight of 368.40 g/mol. Its IUPAC name is 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
PubChem CID44538803
Molecular FormulaC22H16N4O2
Molecular Weight368.40 g/mol
Exact Mass368.13
IUPAC Name3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2c(-c3ccoc3)nc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C22H16N4O2/c23-21-20-19(25-22(16-10-13-27-14-16)26(20)12-11-24-21)15-6-8-18(9-7-15)28-17-4-2-1-3-5-17/h1-14H,(H2,23,24)
InChIKeyTUGZHCPNPTWOOK-UHFFFAOYSA-N
XLogP5.03
TPSA78.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.40
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(4-aminophenyl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44538701
3-[4-[2-(dimethylamino)ethoxy]phenyl]-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44538805
3-(4-amino-1-bicyclo[2.2.1]heptanyl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 146530325
[(2R,5S)-5-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]oxan-2-yl]methanol
CID 165176268
3-[4-[(dimethylamino)methyl]cyclohexyl]-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44539097
tert-butyl 4-[4-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]pyrazol-1-yl]piperidine-1-carboxylate
CID 44538896
1-[3-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]ethanone
CID 154658368
ethyl 3-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate
CID 140825201
[4-[8-amino-1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]-6-oxabicyclo[3.1.1]hept-4-en-1-yl]methanol
CID 170098887
but-3-en-2-one;3-(3-methylnonan-5-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 142288978
6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine
CID 21036872
1-naphthalen-2-yl-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine
CID 53345681

Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine (CID 44538803) is 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine is Nc1nccn2c(-c3ccoc3)nc(-c3ccc(Oc4ccccc4)cc3)c12.
What is the InChIKey of 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is TUGZHCPNPTWOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4O2/c23-21-20-19(25-22(16-10-13-27-14-16)26(20)12-11-24-21)15-6-8-18(9-7-15)28-17-4-2-1-3-5-17/h1-14H,(H2,23,24).
What are the key properties of 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine?
3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 368.40 g/mol, XLogP of 5.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 44538803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).