7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C14H16BrN3O — CID 65326313

IUPAC7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCOc1ccc(Br)c(CN2CCn3ccnc3C2)c1
InChIInChI=1S/C14H16BrN3O/c1-19-12-2-3-13(15)11(8-12)9-17-6-7-18-5-4-16-14(18)10-17/h2-5,8H,6-7,9-10H2,1H3
InChIKeyYJFIQXFMZTYWFA-UHFFFAOYSA-N
MW322.21 g/mol
LogP2.67
Rot. Bonds3

About 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 65326313) has the molecular formula C14H16BrN3O and a molecular weight of 322.21 g/mol. Its IUPAC name is 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID65326313
Molecular FormulaC14H16BrN3O
Molecular Weight322.21 g/mol
Exact Mass321.05
IUPAC Name7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCOc1ccc(Br)c(CN2CCn3ccnc3C2)c1
InChIInChI=1S/C14H16BrN3O/c1-19-12-2-3-13(15)11(8-12)9-17-6-7-18-5-4-16-14(18)10-17/h2-5,8H,6-7,9-10H2,1H3
InChIKeyYJFIQXFMZTYWFA-UHFFFAOYSA-N
XLogP2.67
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.21
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine with MolForge

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Related Compounds

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methoxyphenol
CID 82980177
7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
CID 65326366
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(4-methoxyphenyl)ethanol
CID 62407126
2-[4-[(2-bromo-5-methoxyphenyl)methyl]-1,4-diazepan-1-yl]ethanol
CID 65327008
1-[(2-bromo-5-methoxyphenyl)methyl]-4-butan-2-ylpiperazine
CID 65326018
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N-methylpyridin-2-amine
CID 55145384
1-[(2-bromo-4-methoxyphenyl)methyl]pyrrolidine
CID 117220863
1-[(2-bromo-5-methoxyphenyl)methyl]-3-methylpiperidine
CID 65326691
(3S)-1-[(2-bromo-5-methoxyphenyl)methyl]-3-methoxypyrrolidine
CID 172647769
(3S)-1-[(2-bromo-5-methoxyphenyl)methyl]pyrrolidin-3-amine
CID 115302526
2-[4-[(2-bromo-5-methoxyphenyl)methyl]piperazin-1-yl]-N'-hydroxyethanimidamide
CID 77065238
3-[(2-bromo-5-methoxyphenyl)methyl]-3,9-diazabicyclo[4.2.1]nonane
CID 115314259

Frequently Asked Questions

What is the IUPAC name of 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 65326313) is 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is COc1ccc(Br)c(CN2CCn3ccnc3C2)c1.
What is the InChIKey of 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is YJFIQXFMZTYWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O/c1-19-12-2-3-13(15)11(8-12)9-17-6-7-18-5-4-16-14(18)10-17/h2-5,8H,6-7,9-10H2,1H3.
What are the key properties of 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 322.21 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-bromo-5-methoxyphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 65326313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).