8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine

C15H16BrN5 — CID 80749365

IUPAC8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(Nc2ccc(Br)c(C)c2)n1
InChIInChI=1S/C15H16BrN5/c1-3-17-13-9-21-7-6-18-15(21)14(20-13)19-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3,(H,19,20)
InChIKeyAEWZYCRDDIJDEZ-UHFFFAOYSA-N
MW346.23 g/mol
LogP3.98
Rot. Bonds4

About 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine

8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80749365) has the molecular formula C15H16BrN5 and a molecular weight of 346.23 g/mol. Its IUPAC name is 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80749365
Molecular FormulaC15H16BrN5
Molecular Weight346.23 g/mol
Exact Mass345.06
IUPAC Name8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(Nc2ccc(Br)c(C)c2)n1
InChIInChI=1S/C15H16BrN5/c1-3-17-13-9-21-7-6-18-15(21)14(20-13)19-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3,(H,19,20)
InChIKeyAEWZYCRDDIJDEZ-UHFFFAOYSA-N
XLogP3.98
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.23
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-N-(3,4-dichlorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80768774
6-N-ethyl-8-N-(3-methoxyphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80751540
8-N-(2-bromo-4-fluorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80749003
8-N-(5-bromo-2-fluorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80776403
8-N-(4-methylphenyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80751543
8-N-(2-chloro-5-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 107638907
8-N-(4-bromo-3-methoxyphenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 82860804
6-N-ethyl-8-N-(2-fluoro-5-methylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80747790
8-N-(2-bromo-3-chlorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 103481971
6-N-ethyl-8-N-(2-fluorophenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80760582
6-bromo-N-(4-fluoro-3-methylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 79946448
8-N-(3-bromo-4-methylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80829555

Frequently Asked Questions

What is the IUPAC name of 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine (CID 80749365) is 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine is CCNc1cn2ccnc2c(Nc2ccc(Br)c(C)c2)n1.
What is the InChIKey of 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is AEWZYCRDDIJDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN5/c1-3-17-13-9-21-7-6-18-15(21)14(20-13)19-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3,(H,19,20).
What are the key properties of 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 346.23 g/mol, XLogP of 3.98, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(4-bromo-3-methylphenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80749365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).