3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

C10H10BrN3S — CID 103342008

IUPAC3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
SMILESBrc1ccsc1-c1cnc2n1CCNC2
InChIInChI=1S/C10H10BrN3S/c11-7-1-4-15-10(7)8-5-13-9-6-12-2-3-14(8)9/h1,4-5,12H,2-3,6H2
InChIKeyIMJUGPHMQNRSAS-UHFFFAOYSA-N
MW284.18 g/mol
LogP2.48
Rot. Bonds1

About 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine (PubChem CID 103342008) has the molecular formula C10H10BrN3S and a molecular weight of 284.18 g/mol. Its IUPAC name is 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
PubChem CID103342008
Molecular FormulaC10H10BrN3S
Molecular Weight284.18 g/mol
Exact Mass282.98
IUPAC Name3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
SMILESBrc1ccsc1-c1cnc2n1CCNC2
InChIInChI=1S/C10H10BrN3S/c11-7-1-4-15-10(7)8-5-13-9-6-12-2-3-14(8)9/h1,4-5,12H,2-3,6H2
InChIKeyIMJUGPHMQNRSAS-UHFFFAOYSA-N
XLogP2.48
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The IUPAC name of 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine (CID 103342008) is 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The canonical SMILES for 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine is Brc1ccsc1-c1cnc2n1CCNC2.
What is the InChIKey of 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The InChIKey is IMJUGPHMQNRSAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3S/c11-7-1-4-15-10(7)8-5-13-9-6-12-2-3-14(8)9/h1,4-5,12H,2-3,6H2.
What are the key properties of 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine has a molecular weight of 284.18 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-bromothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine is sourced from PubChem (CID 103342008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).