N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide

C13H14N6O2 — CID 71794856

IUPACN-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1cc(N2CCOCC2)ncn1)c1cnccn1
InChIInChI=1S/C13H14N6O2/c20-13(10-8-14-1-2-15-10)18-11-7-12(17-9-16-11)19-3-5-21-6-4-19/h1-2,7-9H,3-6H2,(H,16,17,18,20)
InChIKeyCRUYVCBYESMIBF-UHFFFAOYSA-N
MW286.29 g/mol
LogP0.36
Rot. Bonds3

About N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide

N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide (PubChem CID 71794856) has the molecular formula C13H14N6O2 and a molecular weight of 286.29 g/mol. Its IUPAC name is N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide
PubChem CID71794856
Molecular FormulaC13H14N6O2
Molecular Weight286.29 g/mol
Exact Mass286.12
IUPAC NameN-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1cc(N2CCOCC2)ncn1)c1cnccn1
InChIInChI=1S/C13H14N6O2/c20-13(10-8-14-1-2-15-10)18-11-7-12(17-9-16-11)19-3-5-21-6-4-19/h1-2,7-9H,3-6H2,(H,16,17,18,20)
InChIKeyCRUYVCBYESMIBF-UHFFFAOYSA-N
XLogP0.36
TPSA93.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide (CID 71794856) is N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide is O=C(Nc1cc(N2CCOCC2)ncn1)c1cnccn1.
What is the InChIKey of N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide?
The InChIKey is CRUYVCBYESMIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O2/c20-13(10-8-14-1-2-15-10)18-11-7-12(17-9-16-11)19-3-5-21-6-4-19/h1-2,7-9H,3-6H2,(H,16,17,18,20).
What are the key properties of N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide?
N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide has a molecular weight of 286.29 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-morpholin-4-ylpyrimidin-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 71794856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).