[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine

C10H9N5O2S — CID 80921214

IUPAC[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine
SMILESNNc1cncc(Sc2ccccc2[N+](=O)[O-])n1
InChIInChI=1S/C10H9N5O2S/c11-14-9-5-12-6-10(13-9)18-8-4-2-1-3-7(8)15(16)17/h1-6H,11H2,(H,13,14)
InChIKeyKFCFGCPHBKIMEC-UHFFFAOYSA-N
MW263.28 g/mol
LogP1.82
Rot. Bonds4

About [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine

[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine (PubChem CID 80921214) has the molecular formula C10H9N5O2S and a molecular weight of 263.28 g/mol. Its IUPAC name is [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine
PubChem CID80921214
Molecular FormulaC10H9N5O2S
Molecular Weight263.28 g/mol
Exact Mass263.05
IUPAC Name[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine
SMILESNNc1cncc(Sc2ccccc2[N+](=O)[O-])n1
InChIInChI=1S/C10H9N5O2S/c11-14-9-5-12-6-10(13-9)18-8-4-2-1-3-7(8)15(16)17/h1-6H,11H2,(H,13,14)
InChIKeyKFCFGCPHBKIMEC-UHFFFAOYSA-N
XLogP1.82
TPSA106.97 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.28
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-ethyl-6-(2-nitrophenyl)sulfanylpyrimidin-4-yl]hydrazine
CID 80939777
[6-(2-nitrophenyl)sulfanyl-2-propylpyrimidin-4-yl]hydrazine
CID 80943848
4-N-ethyl-6-(2-nitrophenyl)sulfanylpyrimidine-2,4-diamine
CID 80884456
2-chloro-4-methyl-6-(2-nitrophenyl)sulfanylpyrimidine
CID 62480994
[4-(2-nitrophenyl)sulfanylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336539
6-(2-nitrophenyl)sulfanylpyridine-2-carbonitrile
CID 64595786
4-fluoro-6-(2-nitrophenyl)sulfanylpyrimidine
CID 115417324
3-(2-nitrophenyl)sulfanylpyridine-4-carboxylic acid
CID 114289002
5-bromo-N-methyl-4-(2-nitrophenyl)sulfanylpyrimidin-2-amine
CID 80884370
[5-[(2-nitrophenyl)sulfanylmethyl]-1,3-thiazol-2-yl]hydrazine
CID 79764045
(5-nitro-6-thiophen-2-ylsulfanyl-2-pyridinyl)hydrazine
CID 80924380
[4-(2-nitrophenyl)sulfanylphenyl]methanamine
CID 63807472

Frequently Asked Questions

What is the IUPAC name of [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine?
The IUPAC name of [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine (CID 80921214) is [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine.
What is the SMILES notation for [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine?
The canonical SMILES for [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine is NNc1cncc(Sc2ccccc2[N+](=O)[O-])n1.
What is the InChIKey of [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine?
The InChIKey is KFCFGCPHBKIMEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5O2S/c11-14-9-5-12-6-10(13-9)18-8-4-2-1-3-7(8)15(16)17/h1-6H,11H2,(H,13,14).
What are the key properties of [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine?
[6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine has a molecular weight of 263.28 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-nitrophenyl)sulfanylpyrazin-2-yl]hydrazine is sourced from PubChem (CID 80921214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).