6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine

C13H10ClN3 — CID 6538792

IUPAC6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
SMILESCc1c(-c2ccc(Cl)cc2)[nH]c2nccnc12
InChIInChI=1S/C13H10ClN3/c1-8-11(9-2-4-10(14)5-3-9)17-13-12(8)15-6-7-16-13/h2-7H,1H3,(H,16,17)
InChIKeySZRBJCSOUDDITM-UHFFFAOYSA-N
MW243.70 g/mol
LogP3.59
Rot. Bonds1

About 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine

6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 6538792) has the molecular formula C13H10ClN3 and a molecular weight of 243.70 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
PubChem CID6538792
Molecular FormulaC13H10ClN3
Molecular Weight243.70 g/mol
Exact Mass243.06
IUPAC Name6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
SMILESCc1c(-c2ccc(Cl)cc2)[nH]c2nccnc12
InChIInChI=1S/C13H10ClN3/c1-8-11(9-2-4-10(14)5-3-9)17-13-12(8)15-6-7-16-13/h2-7H,1H3,(H,16,17)
InChIKeySZRBJCSOUDDITM-UHFFFAOYSA-N
XLogP3.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.70
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
Laduviglusib
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L-745870
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2-(pyridin-3-yl)-1H-1,3-benzodiazole
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2-(pyridin-4-yl)-1H-1,3-benzodiazole
CID 247634
2-(4-Chlorophenyl)imidazo(1,2-a)pyridine
CID 745769
6-chloro-7-(4-(4-chlorobenzyl)piperazin-1-yl)-2-(1,3-dimethyl-1H-pyrazol-4-yl)-3H-imidazo(4,5-b)pyridine
CID 71454279
4-(4-chlorobenzyl)-1-(7H-pyrrolo(2,3-d)pyrimidin-4-yl)piperidin-4-amine
CID 17751819
FR-79620
CID 10421577
6-Chloro-2-(2-pyridinyl)-1H-benzimidazole
CID 186763
2-((4-Chlorophenyl)methyl)-1H-benzimidazole
CID 225500
1-(4-(4-chlorobenzyl)-1-(7H-pyrrolo(2,3-d)pyrimidin-4-yl)piperidin-4-yl)methanamine
CID 11696113

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine (CID 6538792) is 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine is Cc1c(-c2ccc(Cl)cc2)[nH]c2nccnc12.
What is the InChIKey of 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is SZRBJCSOUDDITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3/c1-8-11(9-2-4-10(14)5-3-9)17-13-12(8)15-6-7-16-13/h2-7H,1H3,(H,16,17).
What are the key properties of 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine?
6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 243.70 g/mol, XLogP of 3.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 6538792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).