2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine

C14H21BrN6 — CID 79954324

IUPAC2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCN1CCN(c2nc(Br)cn3ccnc23)CC1
InChIInChI=1S/C14H21BrN6/c1-18(2)5-6-19-7-9-20(10-8-19)14-13-16-3-4-21(13)11-12(15)17-14/h3-4,11H,5-10H2,1-2H3
InChIKeyYUGDTOSTPDOHCE-UHFFFAOYSA-N
MW353.27 g/mol
LogP1.18
Rot. Bonds4

About 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine

2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine (PubChem CID 79954324) has the molecular formula C14H21BrN6 and a molecular weight of 353.27 g/mol. Its IUPAC name is 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine
PubChem CID79954324
Molecular FormulaC14H21BrN6
Molecular Weight353.27 g/mol
Exact Mass352.10
IUPAC Name2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCN1CCN(c2nc(Br)cn3ccnc23)CC1
InChIInChI=1S/C14H21BrN6/c1-18(2)5-6-19-7-9-20(10-8-19)14-13-16-3-4-21(13)11-12(15)17-14/h3-4,11H,5-10H2,1-2H3
InChIKeyYUGDTOSTPDOHCE-UHFFFAOYSA-N
XLogP1.18
TPSA39.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.27
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-Bromoimidazo(1,2-a)pyrazine
CID 137318
6,8-Dibromoimidazo[1,2-a]pyrazine
CID 15025843
Imidazo(1,2-a)pyrazine
CID 2771670
8-(1-Piperazinyl)imidazo(1,2-a)pyrazine
CID 131268
3-Bromoimidazo[1,2-a]pyrazin-2-amine
CID 24971926
Imidazo(1,2-a)pyrazin-8-amine, 3-bromo-N-methyl-
CID 3088360
Pab 13
CID 3088362
6-Bromo-8-(ethylamino)imidazo(1,2-a)pyrazine
CID 3088363
5-Bromo-8-piperazin-1-yl-imidazo[1,2-a]pyrazine
CID 10379016
6-Bromo-8-(piperazin-1-yl)imidazo[1,2-a]pyrazine
CID 46228424
Imidazo(1,2-a)pyrazin-8-amine, 6-bromo-
CID 3088361
Imidazo[1,2-a]pyrazin-8-amine
CID 10261137

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine (CID 79954324) is 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine is CN(C)CCN1CCN(c2nc(Br)cn3ccnc23)CC1.
What is the InChIKey of 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine?
The InChIKey is YUGDTOSTPDOHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN6/c1-18(2)5-6-19-7-9-20(10-8-19)14-13-16-3-4-21(13)11-12(15)17-14/h3-4,11H,5-10H2,1-2H3.
What are the key properties of 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine?
2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine has a molecular weight of 353.27 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 79954324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).