N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide

C19H23N5O3 — CID 109277702

IUPACN-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnc(NCCN3CCOCC3)cn2)cc1
InChIInChI=1S/C19H23N5O3/c1-14(25)15-2-4-16(5-3-15)23-19(26)17-12-22-18(13-21-17)20-6-7-24-8-10-27-11-9-24/h2-5,12-13H,6-11H2,1H3,(H,20,22)(H,23,26)
InChIKeyRYVZUNSIJSCFAU-UHFFFAOYSA-N
MW369.43 g/mol
LogP1.68
Rot. Bonds7

About N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide

N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide (PubChem CID 109277702) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
PubChem CID109277702
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC NameN-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnc(NCCN3CCOCC3)cn2)cc1
InChIInChI=1S/C19H23N5O3/c1-14(25)15-2-4-16(5-3-15)23-19(26)17-12-22-18(13-21-17)20-6-7-24-8-10-27-11-9-24/h2-5,12-13H,6-11H2,1H3,(H,20,22)(H,23,26)
InChIKeyRYVZUNSIJSCFAU-UHFFFAOYSA-N
XLogP1.68
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide (CID 109277702) is N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide is CC(=O)c1ccc(NC(=O)c2cnc(NCCN3CCOCC3)cn2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The InChIKey is RYVZUNSIJSCFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-14(25)15-2-4-16(5-3-15)23-19(26)17-12-22-18(13-21-17)20-6-7-24-8-10-27-11-9-24/h2-5,12-13H,6-11H2,1H3,(H,20,22)(H,23,26).
What are the key properties of N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 1.68, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109277702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).