6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide

C19H15Cl2N3O — CID 52949221

IUPAC6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1cncc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C19H15Cl2N3O/c20-15-5-1-13(2-6-15)9-10-23-19(25)18-12-22-11-17(24-18)14-3-7-16(21)8-4-14/h1-8,11-12H,9-10H2,(H,23,25)
InChIKeyDMUGWPYKKXFQFR-UHFFFAOYSA-N
MW372.26 g/mol
LogP4.42
Rot. Bonds5

About 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide

6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide (PubChem CID 52949221) has the molecular formula C19H15Cl2N3O and a molecular weight of 372.26 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
PubChem CID52949221
Molecular FormulaC19H15Cl2N3O
Molecular Weight372.26 g/mol
Exact Mass371.06
IUPAC Name6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1cncc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C19H15Cl2N3O/c20-15-5-1-13(2-6-15)9-10-23-19(25)18-12-22-11-17(24-18)14-3-7-16(21)8-4-14/h1-8,11-12H,9-10H2,(H,23,25)
InChIKeyDMUGWPYKKXFQFR-UHFFFAOYSA-N
XLogP4.42
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.26
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide (CID 52949221) is 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide is O=C(NCCc1ccc(Cl)cc1)c1cncc(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide?
The InChIKey is DMUGWPYKKXFQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O/c20-15-5-1-13(2-6-15)9-10-23-19(25)18-12-22-11-17(24-18)14-3-7-16(21)8-4-14/h1-8,11-12H,9-10H2,(H,23,25).
What are the key properties of 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide?
6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide has a molecular weight of 372.26 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 52949221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).