[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine

C14H18N4S — CID 103062114

IUPAC[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
SMILESCc1cc(C)cc(CSCc2cnc(NN)cn2)c1
InChIInChI=1S/C14H18N4S/c1-10-3-11(2)5-12(4-10)8-19-9-13-6-17-14(18-15)7-16-13/h3-7H,8-9,15H2,1-2H3,(H,17,18)
InChIKeyKHGDZSFTRYBWSN-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.81
Rot. Bonds5

About [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine

[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine (PubChem CID 103062114) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
PubChem CID103062114
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
SMILESCc1cc(C)cc(CSCc2cnc(NN)cn2)c1
InChIInChI=1S/C14H18N4S/c1-10-3-11(2)5-12(4-10)8-19-9-13-6-17-14(18-15)7-16-13/h3-7H,8-9,15H2,1-2H3,(H,17,18)
InChIKeyKHGDZSFTRYBWSN-UHFFFAOYSA-N
XLogP2.81
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine 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

[5-[(3-methylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062082
[5-(2-methylpropylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062043
[5-(3-methylbutylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 107756789
[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062099
tert-butyl 2-[(5-hydrazinylpyrazin-2-yl)methylsulfanyl]acetate
CID 103062127
[5-(3-methylbutan-2-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 107756750
(5-propylpyrazin-2-yl)hydrazine
CID 123407613
1-(5-hydrazinylpyrazin-2-yl)-N,N-dimethylmethanamine
CID 103060816
[5-(naphthalen-2-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062053
[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062018
[5-[(3,5-dimethylphenyl)methylsulfanyl]-2-pyridinyl]methanamine
CID 113321432
N-[(5-hydrazinylpyrazin-2-yl)methyl]-N-methyl-2-methylsulfanylethanamine
CID 103061186

Frequently Asked Questions

What is the IUPAC name of [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine?
The IUPAC name of [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine (CID 103062114) is [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine is Cc1cc(C)cc(CSCc2cnc(NN)cn2)c1.
What is the InChIKey of [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine?
The InChIKey is KHGDZSFTRYBWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-10-3-11(2)5-12(4-10)8-19-9-13-6-17-14(18-15)7-16-13/h3-7H,8-9,15H2,1-2H3,(H,17,18).
What are the key properties of [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine?
[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine has a molecular weight of 274.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103062114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).