5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

C18H20N6O2 — CID 109277590

IUPAC5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESN#Cc1ccc(Nc2cnc(C(=O)NCCN3CCOCC3)cn2)cc1
InChIInChI=1S/C18H20N6O2/c19-11-14-1-3-15(4-2-14)23-17-13-21-16(12-22-17)18(25)20-5-6-24-7-9-26-10-8-24/h1-4,12-13H,5-10H2,(H,20,25)(H,22,23)
InChIKeyDDRKEZVZOWOKSC-UHFFFAOYSA-N
MW352.40 g/mol
LogP1.15
Rot. Bonds6

About 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (PubChem CID 109277590) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
PubChem CID109277590
Molecular FormulaC18H20N6O2
Molecular Weight352.40 g/mol
Exact Mass352.16
IUPAC Name5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESN#Cc1ccc(Nc2cnc(C(=O)NCCN3CCOCC3)cn2)cc1
InChIInChI=1S/C18H20N6O2/c19-11-14-1-3-15(4-2-14)23-17-13-21-16(12-22-17)18(25)20-5-6-24-7-9-26-10-8-24/h1-4,12-13H,5-10H2,(H,20,25)(H,22,23)
InChIKeyDDRKEZVZOWOKSC-UHFFFAOYSA-N
XLogP1.15
TPSA103.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide
CID 109270948
N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
CID 109277458
5-(methylamino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 107374273
6-N-(4-cyanophenyl)-2-N-(2-morpholin-4-ylethyl)pyridine-2,6-dicarboxamide
CID 109096501
5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
CID 63717300
5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277582
5-(2-methoxyanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277550
6-(3-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115775
5-(3-chloro-2-methylanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277542
5-[(4-chlorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277474
1-N'-(4-cyanophenyl)-1-N-(2-morpholin-4-ylethyl)cyclopropane-1,1-dicarboxamide
CID 108973717
N-(2-morpholin-4-ylethyl)-5-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109185754

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (CID 109277590) is 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is N#Cc1ccc(Nc2cnc(C(=O)NCCN3CCOCC3)cn2)cc1.
What is the InChIKey of 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The InChIKey is DDRKEZVZOWOKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c19-11-14-1-3-15(4-2-14)23-17-13-21-16(12-22-17)18(25)20-5-6-24-7-9-26-10-8-24/h1-4,12-13H,5-10H2,(H,20,25)(H,22,23).
What are the key properties of 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide has a molecular weight of 352.40 g/mol, XLogP of 1.15, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109277590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).