ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate

C11H12N2O2 — CID 178138656

IUPACethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate
SMILESCCOC(=O)c1cn2ccncc2c1C
InChIInChI=1S/C11H12N2O2/c1-3-15-11(14)9-7-13-5-4-12-6-10(13)8(9)2/h4-7H,3H2,1-2H3
InChIKeyWOPMZYGUWMZPRA-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.82
Rot. Bonds2

About ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate

ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate (PubChem CID 178138656) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate.

Molecular Properties

Compound Nameethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate
PubChem CID178138656
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Nameethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate
SMILESCCOC(=O)c1cn2ccncc2c1C
InChIInChI=1S/C11H12N2O2/c1-3-15-11(14)9-7-13-5-4-12-6-10(13)8(9)2/h4-7H,3H2,1-2H3
InChIKeyWOPMZYGUWMZPRA-UHFFFAOYSA-N
XLogP1.82
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-chloro-8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate
CID 59788143
8-ethoxy-7-methylpyrrolo[1,2-a]pyrazine
CID 13494209
ethyl 6-methylimidazo[1,2-a]pyridine-7-carboxylate
CID 76849693
ethyl 3-propan-2-ylpyridine-4-carboxylate
CID 131699762
ethyl 4-(hydroxymethyl)pyridine-3-carboxylate
CID 112757154
ethyl 2-imidazo[1,2-a]pyrazin-2-ylpropanoate
CID 12674613
ethyl 4-fluoro-5-methylpyridine-3-carboxylate
CID 130953044
ethyl 4-methoxy-5-methylpyridine-3-carboxylate
CID 133096766
ethyl 1-[(3-methyl-4-pyridinyl)methyl]imidazole-4-carboxylate
CID 114203788
ethyl 2-oxo-1-phenyl-1,7-naphthyridine-3-carboxylate
CID 122512958
ethyl 2-(3-aminopropyl)-3-oxoimidazo[1,5-a]pyrazine-1-carboxylate;hydrochloride
CID 155213643
ethyl 4-chloro-5-methylpyrrolo[1,2-b]pyridazine-6-carboxylate
CID 58859633

Frequently Asked Questions

What is the IUPAC name of ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate?
The IUPAC name of ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate (CID 178138656) is ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate.
What is the SMILES notation for ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate?
The canonical SMILES for ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate is CCOC(=O)c1cn2ccncc2c1C.
What is the InChIKey of ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate?
The InChIKey is WOPMZYGUWMZPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-3-15-11(14)9-7-13-5-4-12-6-10(13)8(9)2/h4-7H,3H2,1-2H3.
What are the key properties of ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate?
ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate has a molecular weight of 204.23 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 8-methylpyrrolo[1,2-a]pyrazine-7-carboxylate is sourced from PubChem (CID 178138656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).