2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one

C10H11N5OS — CID 80892748

IUPAC2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one
SMILESCCNc1cncc(Sc2nccc(=O)[nH]2)n1
InChIInChI=1S/C10H11N5OS/c1-2-12-7-5-11-6-9(14-7)17-10-13-4-3-8(16)15-10/h3-6H,2H2,1H3,(H,12,14)(H,13,15,16)
InChIKeyQYMHJGYMGSVKLR-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.14
Rot. Bonds4

About 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one

2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one (PubChem CID 80892748) has the molecular formula C10H11N5OS and a molecular weight of 249.30 g/mol. Its IUPAC name is 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one
PubChem CID80892748
Molecular FormulaC10H11N5OS
Molecular Weight249.30 g/mol
Exact Mass249.07
IUPAC Name2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one
SMILESCCNc1cncc(Sc2nccc(=O)[nH]2)n1
InChIInChI=1S/C10H11N5OS/c1-2-12-7-5-11-6-9(14-7)17-10-13-4-3-8(16)15-10/h3-6H,2H2,1H3,(H,12,14)(H,13,15,16)
InChIKeyQYMHJGYMGSVKLR-UHFFFAOYSA-N
XLogP1.14
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(ethylamino)pyrimidin-4-yl]sulfanyl-1H-pyrimidin-6-one
CID 80893473
2-[2-(ethylamino)-5-fluoropyrimidin-4-yl]sulfanyl-1H-pyrimidin-6-one
CID 80893235
2-[(3-chloro-1,2,4-triazin-5-yl)sulfanyl]-1H-pyrimidin-6-one
CID 115000993
6-[(3-bromo-2-pyridinyl)sulfanyl]-N-ethylpyrazin-2-amine
CID 80890787
2-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]sulfanyl-1H-pyrimidin-6-one
CID 80893952
2-[[6-(ethylamino)-2-pyridinyl]methylsulfanyl]-1H-pyrimidin-6-one
CID 79239990
2-[[3,5-dichloro-6-(ethylamino)-2-pyridinyl]sulfanyl]-1H-pyrimidin-6-one
CID 102761278
2-[2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-1H-pyrimidin-6-one
CID 103334011
N-ethyl-6-(1-methylimidazol-2-yl)sulfanylpyrazin-2-amine
CID 78990307
2-[[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]-1H-pyrimidin-6-one
CID 80893711
2-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methylsulfanyl]-1H-pyrimidin-6-one
CID 80654238
N-ethyl-6-(4-propan-2-ylphenyl)sulfanylpyrazin-2-amine
CID 80885114

Frequently Asked Questions

What is the IUPAC name of 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one?
The IUPAC name of 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one (CID 80892748) is 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one is CCNc1cncc(Sc2nccc(=O)[nH]2)n1.
What is the InChIKey of 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one?
The InChIKey is QYMHJGYMGSVKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5OS/c1-2-12-7-5-11-6-9(14-7)17-10-13-4-3-8(16)15-10/h3-6H,2H2,1H3,(H,12,14)(H,13,15,16).
What are the key properties of 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one?
2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one has a molecular weight of 249.30 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(ethylamino)pyrazin-2-yl]sulfanyl-1H-pyrimidin-6-one is sourced from PubChem (CID 80892748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).