N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide

C18H14Cl2N4O — CID 109281944

IUPACN-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cnc(NCc2ccccc2Cl)cn1
InChIInChI=1S/C18H14Cl2N4O/c19-13-5-3-6-14(8-13)24-18(25)16-10-23-17(11-21-16)22-9-12-4-1-2-7-15(12)20/h1-8,10-11H,9H2,(H,22,23)(H,24,25)
InChIKeyGQUYRXPWZROWIR-UHFFFAOYSA-N
MW373.24 g/mol
LogP4.65
Rot. Bonds5

About N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide

N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide (PubChem CID 109281944) has the molecular formula C18H14Cl2N4O and a molecular weight of 373.24 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
PubChem CID109281944
Molecular FormulaC18H14Cl2N4O
Molecular Weight373.24 g/mol
Exact Mass372.05
IUPAC NameN-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cnc(NCc2ccccc2Cl)cn1
InChIInChI=1S/C18H14Cl2N4O/c19-13-5-3-6-14(8-13)24-18(25)16-10-23-17(11-21-16)22-9-12-4-1-2-7-15(12)20/h1-8,10-11H,9H2,(H,22,23)(H,24,25)
InChIKeyGQUYRXPWZROWIR-UHFFFAOYSA-N
XLogP4.65
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.24
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-chlorophenyl)methylamino]-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109281970
N-(3-chlorophenyl)-6-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156799
N-(3-chlorophenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283424
N-(3-chlorophenyl)-5-(prop-2-enylamino)pyrazine-2-carboxamide
CID 109272257
N-(3-bromophenyl)-5-[(2-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280199
N-(2-tert-butylphenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281939
1-(3-chlorophenyl)-3-[(2-chlorophenyl)methyl]urea
CID 727865
5-(3-chloroanilino)-N-(2,6-dichlorophenyl)pyrazine-2-carboxamide
CID 109292809
5-[(2-fluorophenyl)methylamino]-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109281495
N-(3-acetylphenyl)-5-[(4-chlorophenyl)methylamino]pyrazine-2-carboxamide
CID 109282153
N-(3-chlorophenyl)-5-(4-fluoroanilino)pyrazine-2-carboxamide
CID 109292535
6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109156828

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide (CID 109281944) is N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide is O=C(Nc1cccc(Cl)c1)c1cnc(NCc2ccccc2Cl)cn1.
What is the InChIKey of N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide?
The InChIKey is GQUYRXPWZROWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N4O/c19-13-5-3-6-14(8-13)24-18(25)16-10-23-17(11-21-16)22-9-12-4-1-2-7-15(12)20/h1-8,10-11H,9H2,(H,22,23)(H,24,25).
What are the key properties of N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide?
N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide has a molecular weight of 373.24 g/mol, XLogP of 4.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 109281944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).