[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine

C12H14N4OS — CID 103062018

IUPAC[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine
SMILESCOc1cccc(SCc2cnc(NN)cn2)c1
InChIInChI=1S/C12H14N4OS/c1-17-10-3-2-4-11(5-10)18-8-9-6-15-12(16-13)7-14-9/h2-7H,8,13H2,1H3,(H,15,16)
InChIKeyGYKCGXQIKDDVKT-UHFFFAOYSA-N
MW262.34 g/mol
LogP2.06
Rot. Bonds5

About [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine

[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine (PubChem CID 103062018) has the molecular formula C12H14N4OS and a molecular weight of 262.34 g/mol. Its IUPAC name is [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine
PubChem CID103062018
Molecular FormulaC12H14N4OS
Molecular Weight262.34 g/mol
Exact Mass262.09
IUPAC Name[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine
SMILESCOc1cccc(SCc2cnc(NN)cn2)c1
InChIInChI=1S/C12H14N4OS/c1-17-10-3-2-4-11(5-10)18-8-9-6-15-12(16-13)7-14-9/h2-7H,8,13H2,1H3,(H,15,16)
InChIKeyGYKCGXQIKDDVKT-UHFFFAOYSA-N
XLogP2.06
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[5-(naphthalen-2-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062053
[5-[(2-bromo-4-methoxyphenoxy)methyl]pyrazin-2-yl]hydrazine
CID 103061987
[4-[(3-methoxyphenyl)sulfanylmethyl]-2-pyridinyl]methanamine
CID 63883446
5-[(4-methoxyphenyl)sulfanylmethyl]-N-propylpyrazin-2-amine
CID 103059724
2-[(3-methoxyphenyl)sulfanylmethyl]benzohydrazide
CID 63580788
[5-[(3-methylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062082
[5-(2-methylpropylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062043
3,6-dichloro-2-[(3-methoxyphenyl)sulfanylmethyl]pyridine
CID 55127840
5-[(3-methoxyphenyl)methylsulfanyl]pyridin-2-amine
CID 43302210
[2-methoxy-5-[(3-methoxyphenyl)sulfanylmethyl]phenyl]methanamine
CID 65338277
2-chloro-4-[(3-methoxyphenyl)sulfanylmethyl]pyridine
CID 62046322
N-(5-chloro-2-pyridinyl)-2-(3-methoxyphenyl)sulfanylacetamide
CID 47152631

Frequently Asked Questions

What is the IUPAC name of [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine?
The IUPAC name of [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine (CID 103062018) is [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine is COc1cccc(SCc2cnc(NN)cn2)c1.
What is the InChIKey of [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine?
The InChIKey is GYKCGXQIKDDVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS/c1-17-10-3-2-4-11(5-10)18-8-9-6-15-12(16-13)7-14-9/h2-7H,8,13H2,1H3,(H,15,16).
What are the key properties of [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine?
[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine has a molecular weight of 262.34 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103062018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).