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

C17H28N6O3 — CID 109277458

IUPACN-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc(NCCN2CCOCC2)cn1
InChIInChI=1S/C17H28N6O3/c24-17(19-2-4-23-7-11-26-12-8-23)15-13-21-16(14-20-15)18-1-3-22-5-9-25-10-6-22/h13-14H,1-12H2,(H,18,21)(H,19,24)
InChIKeyOGSCUNGSEALXPN-UHFFFAOYSA-N
MW364.45 g/mol
LogP-0.72
Rot. Bonds8

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

N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide (PubChem CID 109277458) has the molecular formula C17H28N6O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
PubChem CID109277458
Molecular FormulaC17H28N6O3
Molecular Weight364.45 g/mol
Exact Mass364.22
IUPAC NameN-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc(NCCN2CCOCC2)cn1
InChIInChI=1S/C17H28N6O3/c24-17(19-2-4-23-7-11-26-12-8-23)15-13-21-16(14-20-15)18-1-3-22-5-9-25-10-6-22/h13-14H,1-12H2,(H,18,21)(H,19,24)
InChIKeyOGSCUNGSEALXPN-UHFFFAOYSA-N
XLogP-0.72
TPSA91.85 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide (CID 109277458) is N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide is O=C(NCCN1CCOCC1)c1cnc(NCCN2CCOCC2)cn1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
The InChIKey is OGSCUNGSEALXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N6O3/c24-17(19-2-4-23-7-11-26-12-8-23)15-13-21-16(14-20-15)18-1-3-22-5-9-25-10-6-22/h13-14H,1-12H2,(H,18,21)(H,19,24).
What are the key properties of N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide?
N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide has a molecular weight of 364.45 g/mol, XLogP of -0.72, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109277458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).