2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide

C10H12BrN5O — CID 79956326

IUPAC2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H12BrN5O/c1-15(2)8(17)5-13-9-10-12-3-4-16(10)6-7(11)14-9/h3-4,6H,5H2,1-2H3,(H,13,14)
InChIKeyBANLLQPNYAYHMW-UHFFFAOYSA-N
MW298.14 g/mol
LogP0.99
Rot. Bonds3

About 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide

2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide (PubChem CID 79956326) has the molecular formula C10H12BrN5O and a molecular weight of 298.14 g/mol. Its IUPAC name is 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide
PubChem CID79956326
Molecular FormulaC10H12BrN5O
Molecular Weight298.14 g/mol
Exact Mass297.02
IUPAC Name2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H12BrN5O/c1-15(2)8(17)5-13-9-10-12-3-4-16(10)6-7(11)14-9/h3-4,6H,5H2,1-2H3,(H,13,14)
InChIKeyBANLLQPNYAYHMW-UHFFFAOYSA-N
XLogP0.99
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.14
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide (CID 79956326) is 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide is CN(C)C(=O)CNc1nc(Br)cn2ccnc12.
What is the InChIKey of 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide?
The InChIKey is BANLLQPNYAYHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN5O/c1-15(2)8(17)5-13-9-10-12-3-4-16(10)6-7(11)14-9/h3-4,6H,5H2,1-2H3,(H,13,14).
What are the key properties of 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide?
2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide has a molecular weight of 298.14 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 79956326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).