N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide

C15H14N6O — CID 122297962

IUPACN-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide
SMILESCN(C)c1ncc(NC(=O)c2cnc3ccccc3n2)cn1
InChIInChI=1S/C15H14N6O/c1-21(2)15-17-7-10(8-18-15)19-14(22)13-9-16-11-5-3-4-6-12(11)20-13/h3-9H,1-2H3,(H,19,22)
InChIKeyNPFYEEWNGKZYIW-UHFFFAOYSA-N
MW294.32 g/mol
LogP1.74
Rot. Bonds3

About N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide

N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide (PubChem CID 122297962) has the molecular formula C15H14N6O and a molecular weight of 294.32 g/mol. Its IUPAC name is N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide
PubChem CID122297962
Molecular FormulaC15H14N6O
Molecular Weight294.32 g/mol
Exact Mass294.12
IUPAC NameN-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide
SMILESCN(C)c1ncc(NC(=O)c2cnc3ccccc3n2)cn1
InChIInChI=1S/C15H14N6O/c1-21(2)15-17-7-10(8-18-15)19-14(22)13-9-16-11-5-3-4-6-12(11)20-13/h3-9H,1-2H3,(H,19,22)
InChIKeyNPFYEEWNGKZYIW-UHFFFAOYSA-N
XLogP1.74
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-phenoxypyrimidin-5-yl)quinoxaline-2-carboxamide
CID 122302374
N-(4-ethoxyphenyl)quinoxaline-2-carboxamide
CID 2738538
N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
CID 131923245
N-(2-bromophenyl)quinoxaline-2-carboxamide
CID 17429565
N-(4-pyrimidin-2-yloxyphenyl)quinoxaline-2-carboxamide
CID 47051300
N-(1-phenylpyrazol-4-yl)quinoxaline-2-carboxamide
CID 71884776
N-(6-chloropyrazin-2-yl)quinoxaline-2-carboxamide
CID 104938179
N-[5-[[2-(dimethylamino)acetyl]amino]-2-methylphenyl]quinoxaline-2-carboxamide
CID 131912464
N-[(2R)-2-cyclopropyl-2-(dimethylamino)ethyl]quinoxaline-2-carboxamide
CID 94159016
N-[2-(dimethylamino)pyrimidin-5-yl]-4-phenyl-1,3-thiazole-2-carboxamide
CID 136517401
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-2-carboxamide
CID 26469458
N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoxaline-2-carboxamide
CID 53382181

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide (CID 122297962) is N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide is CN(C)c1ncc(NC(=O)c2cnc3ccccc3n2)cn1.
What is the InChIKey of N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide?
The InChIKey is NPFYEEWNGKZYIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O/c1-21(2)15-17-7-10(8-18-15)19-14(22)13-9-16-11-5-3-4-6-12(11)20-13/h3-9H,1-2H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide?
N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide has a molecular weight of 294.32 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide is sourced from PubChem (CID 122297962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).