6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine

C12H17BrN4 — CID 79958961

IUPAC6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)CCN(C)c1nc(Br)cn2ccnc12
InChIInChI=1S/C12H17BrN4/c1-9(2)4-6-16(3)12-11-14-5-7-17(11)8-10(13)15-12/h5,7-9H,4,6H2,1-3H3
InChIKeyHFPNMXSZOCBBJC-UHFFFAOYSA-N
MW297.20 g/mol
LogP2.97
Rot. Bonds4

About 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine

6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 79958961) has the molecular formula C12H17BrN4 and a molecular weight of 297.20 g/mol. Its IUPAC name is 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID79958961
Molecular FormulaC12H17BrN4
Molecular Weight297.20 g/mol
Exact Mass296.06
IUPAC Name6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(C)CCN(C)c1nc(Br)cn2ccnc12
InChIInChI=1S/C12H17BrN4/c1-9(2)4-6-16(3)12-11-14-5-7-17(11)8-10(13)15-12/h5,7-9H,4,6H2,1-3H3
InChIKeyHFPNMXSZOCBBJC-UHFFFAOYSA-N
XLogP2.97
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.20
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine (CID 79958961) is 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine is CC(C)CCN(C)c1nc(Br)cn2ccnc12.
What is the InChIKey of 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is HFPNMXSZOCBBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrN4/c1-9(2)4-6-16(3)12-11-14-5-7-17(11)8-10(13)15-12/h5,7-9H,4,6H2,1-3H3.
What are the key properties of 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine?
6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 297.20 g/mol, XLogP of 2.97, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 79958961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).