5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine

C14H21N3 — CID 174196547

IUPAC5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine
SMILESCCn1cc(C(C)C)c2nc(C(C)C)cnc21
InChIInChI=1S/C14H21N3/c1-6-17-8-11(9(2)3)13-14(17)15-7-12(16-13)10(4)5/h7-10H,6H2,1-5H3
InChIKeyNMZBAFQJRGMWSN-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.70
Rot. Bonds3

About 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine

5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine (PubChem CID 174196547) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine
PubChem CID174196547
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine
SMILESCCn1cc(C(C)C)c2nc(C(C)C)cnc21
InChIInChI=1S/C14H21N3/c1-6-17-8-11(9(2)3)13-14(17)15-7-12(16-13)10(4)5/h7-10H,6H2,1-5H3
InChIKeyNMZBAFQJRGMWSN-UHFFFAOYSA-N
XLogP3.70
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-4,6-di(propan-2-yl)pyrrolo[2,3-b]pyridine
CID 165410772
1-(5-methyl-7-propan-2-ylpyrrolo[2,3-b]pyrazin-2-yl)ethanone
CID 158280272
2-methyl-4-propan-2-yl-1-propylimidazole
CID 58592748
1-ethyl-4-propan-2-ylimidazole
CID 10057571
1-ethyl-3,5-di(propan-2-yl)pyrimidine-2,4-dione
CID 166717073
N-(1-chloropropan-2-yl)-1-ethyl-2-methylimidazole-4-sulfonamide
CID 65030909
2,6,8-tri(propan-2-yl)pyrrolo[1,2-b][1,2,4]triazine
CID 170938057
7-ethyl-3-propan-2-ylpyrido[3,4-b]pyrazine
CID 70794246
1-[3-(methylamino)-5-propan-2-ylpyrazin-2-yl]propan-1-one
CID 145188258
3,5-di(propan-2-yl)-2H-pyrazolo[3,4-b]pyrazine
CID 138701227
4-propan-2-yl-1-propylimidazole
CID 58213384
2,5-di(propan-2-yl)pyrazine;2,6-di(propan-2-yl)pyrazine
CID 161386893

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine?
The IUPAC name of 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine (CID 174196547) is 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine is CCn1cc(C(C)C)c2nc(C(C)C)cnc21.
What is the InChIKey of 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine?
The InChIKey is NMZBAFQJRGMWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-6-17-8-11(9(2)3)13-14(17)15-7-12(16-13)10(4)5/h7-10H,6H2,1-5H3.
What are the key properties of 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine?
5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine has a molecular weight of 231.34 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,7-di(propan-2-yl)pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 174196547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).