N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide

C12H12N4OS — CID 80664432

IUPACN-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(Sc2cnc(N)cn2)cc1
InChIInChI=1S/C12H12N4OS/c1-8(17)16-9-2-4-10(5-3-9)18-12-7-14-11(13)6-15-12/h2-7H,1H3,(H2,13,14)(H,16,17)
InChIKeyJXIKARQBANFCCV-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.17
Rot. Bonds3

About N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide

N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide (PubChem CID 80664432) has the molecular formula C12H12N4OS and a molecular weight of 260.32 g/mol. Its IUPAC name is N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide
PubChem CID80664432
Molecular FormulaC12H12N4OS
Molecular Weight260.32 g/mol
Exact Mass260.07
IUPAC NameN-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(Sc2cnc(N)cn2)cc1
InChIInChI=1S/C12H12N4OS/c1-8(17)16-9-2-4-10(5-3-9)18-12-7-14-11(13)6-15-12/h2-7H,1H3,(H2,13,14)(H,16,17)
InChIKeyJXIKARQBANFCCV-UHFFFAOYSA-N
XLogP2.17
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide 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

N-[4-[(5,6-diamino-2-pyridinyl)sulfanyl]phenyl]acetamide
CID 79825462
N-[4-[[6-[(1R)-1-aminoethyl]-3-pyridinyl]sulfanyl]phenyl]acetamide
CID 83123882
N-[4-(6-chloropyrazin-2-yl)sulfanylphenyl]acetamide
CID 43213387
N-[4-(4-acetamido-3-aminophenyl)sulfanylphenyl]acetamide
CID 70625915
N-[4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)sulfanyl]phenyl]acetamide
CID 80893591
N-[4-[[6-[(1S)-1-aminopropyl]-3-pyridinyl]sulfanyl]phenyl]acetamide
CID 103938113
N-(4-acetamidophenyl)-6-aminopyridine-3-carboxamide
CID 110861506
N-[4-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]sulfanyl]phenyl]acetamide
CID 80864660
N-[4-[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)sulfanyl]phenyl]acetamide
CID 80921163
N-[4-(3-amino-4-methylphenyl)sulfanylphenyl]acetamide
CID 62910785
N-[4-(6-chloro-2-propan-2-ylpyrimidin-4-yl)sulfanylphenyl]acetamide
CID 80947124
N-[4-[(6-propanoyl-3-pyridinyl)sulfanyl]phenyl]acetamide
CID 115939141

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide?
The IUPAC name of N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide (CID 80664432) is N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide.
What is the SMILES notation for N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide?
The canonical SMILES for N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide is CC(=O)Nc1ccc(Sc2cnc(N)cn2)cc1.
What is the InChIKey of N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide?
The InChIKey is JXIKARQBANFCCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4OS/c1-8(17)16-9-2-4-10(5-3-9)18-12-7-14-11(13)6-15-12/h2-7H,1H3,(H2,13,14)(H,16,17).
What are the key properties of N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide?
N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide has a molecular weight of 260.32 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-aminopyrazin-2-yl)sulfanylphenyl]acetamide is sourced from PubChem (CID 80664432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).