5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide

C10H14ClN3O3 — CID 107372183

IUPAC5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide
SMILESCOCCN(CCO)C(=O)c1cnc(Cl)cn1
InChIInChI=1S/C10H14ClN3O3/c1-17-5-3-14(2-4-15)10(16)8-6-13-9(11)7-12-8/h6-7,15H,2-5H2,1H3
InChIKeyJLAWMPXFQHXLOR-UHFFFAOYSA-N
MW259.69 g/mol
LogP0.21
Rot. Bonds6

About 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide

5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide (PubChem CID 107372183) has the molecular formula C10H14ClN3O3 and a molecular weight of 259.69 g/mol. Its IUPAC name is 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide
PubChem CID107372183
Molecular FormulaC10H14ClN3O3
Molecular Weight259.69 g/mol
Exact Mass259.07
IUPAC Name5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide
SMILESCOCCN(CCO)C(=O)c1cnc(Cl)cn1
InChIInChI=1S/C10H14ClN3O3/c1-17-5-3-14(2-4-15)10(16)8-6-13-9(11)7-12-8/h6-7,15H,2-5H2,1H3
InChIKeyJLAWMPXFQHXLOR-UHFFFAOYSA-N
XLogP0.21
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.69
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide (CID 107372183) is 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide is COCCN(CCO)C(=O)c1cnc(Cl)cn1.
What is the InChIKey of 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide?
The InChIKey is JLAWMPXFQHXLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O3/c1-17-5-3-14(2-4-15)10(16)8-6-13-9(11)7-12-8/h6-7,15H,2-5H2,1H3.
What are the key properties of 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide?
5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide has a molecular weight of 259.69 g/mol, XLogP of 0.21, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107372183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).