ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate

C10H11ClN2O2 — CID 135262621

IUPACethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate
SMILESCCOC(=O)C1CC1c1cnc(Cl)cn1
InChIInChI=1S/C10H11ClN2O2/c1-2-15-10(14)7-3-6(7)8-4-13-9(11)5-12-8/h4-7H,2-3H2,1H3
InChIKeyZHHSZQFKZOUYKL-UHFFFAOYSA-N
MW226.66 g/mol
LogP1.80
Rot. Bonds3

About ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate

ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate (PubChem CID 135262621) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate.

Molecular Properties

Compound Nameethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate
PubChem CID135262621
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC Nameethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate
SMILESCCOC(=O)C1CC1c1cnc(Cl)cn1
InChIInChI=1S/C10H11ClN2O2/c1-2-15-10(14)7-3-6(7)8-4-13-9(11)5-12-8/h4-7H,2-3H2,1H3
InChIKeyZHHSZQFKZOUYKL-UHFFFAOYSA-N
XLogP1.80
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

trans-ethyl (1R,2R)-2-(5-hydroxy-2-pyridinyl)cyclopropane-1-carboxylate
CID 142405028
trans-ethyl (1R,2R)-2-(5-methoxy-2-pyridinyl)cyclopropane-1-carboxylate
CID 177320992
ethyl 2-(5-hydroxy-2-pyridinyl)cyclopropane-1-carboxylate
CID 153293789
trans-ethyl (1R,2R)-2-(5-fluoro-2-pyridinyl)cyclopropane-1-carboxylate
CID 118512749
trans-ethyl (1R,2R)-2-(6-oxo-1H-pyrazin-3-yl)cyclopropane-1-carboxylate
CID 142405041
trans-(1S,2S)-2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylic acid
CID 135239855
trans-ethyl (1R,2R)-2-pyridin-2-ylcyclopropane-1-carboxylate
CID 66837013
ethyl 1-benzyl-4-(5-chloropyrazin-2-yl)piperidine-3-carboxylate
CID 175598908
ethyl 2-diazoacetate;trans-ethyl (1R,2R)-2-(5-bromopyrazin-2-yl)cyclopropane-1-carboxylate
CID 159118595
trans-ethyl (1S,2S)-2-(4-amino-2-pyridinyl)cyclopropane-1-carboxylate
CID 129268949
ethyl 2-(2-methyl-1,3-oxazol-4-yl)cyclopropane-1-carboxylate
CID 89415647
ethyl 2-(2-bromo-1,3-thiazol-4-yl)cyclopropane-1-carboxylate
CID 118432884

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate?
The IUPAC name of ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate (CID 135262621) is ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate.
What is the SMILES notation for ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate?
The canonical SMILES for ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate is CCOC(=O)C1CC1c1cnc(Cl)cn1.
What is the InChIKey of ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate?
The InChIKey is ZHHSZQFKZOUYKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c1-2-15-10(14)7-3-6(7)8-4-13-9(11)5-12-8/h4-7H,2-3H2,1H3.
What are the key properties of ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate?
ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate has a molecular weight of 226.66 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(5-chloropyrazin-2-yl)cyclopropane-1-carboxylate is sourced from PubChem (CID 135262621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).