N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide

C13H15N5O2 — CID 166095167

IUPACN-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide
SMILESO=C(NC1CCOC(n2ccnc2)C1)c1cnccn1
InChIInChI=1S/C13H15N5O2/c19-13(11-8-14-2-3-16-11)17-10-1-6-20-12(7-10)18-5-4-15-9-18/h2-5,8-10,12H,1,6-7H2,(H,17,19)
InChIKeyJHBMSYSFDPJAEX-UHFFFAOYSA-N
MW273.30 g/mol
LogP0.78
Rot. Bonds3

About N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide

N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide (PubChem CID 166095167) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide
PubChem CID166095167
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC NameN-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide
SMILESO=C(NC1CCOC(n2ccnc2)C1)c1cnccn1
InChIInChI=1S/C13H15N5O2/c19-13(11-8-14-2-3-16-11)17-10-1-6-20-12(7-10)18-5-4-15-9-18/h2-5,8-10,12H,1,6-7H2,(H,17,19)
InChIKeyJHBMSYSFDPJAEX-UHFFFAOYSA-N
XLogP0.78
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide (CID 166095167) is N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide is O=C(NC1CCOC(n2ccnc2)C1)c1cnccn1.
What is the InChIKey of N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide?
The InChIKey is JHBMSYSFDPJAEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c19-13(11-8-14-2-3-16-11)17-10-1-6-20-12(7-10)18-5-4-15-9-18/h2-5,8-10,12H,1,6-7H2,(H,17,19).
What are the key properties of N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide?
N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-yloxan-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 166095167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).