[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine

C9H16N4OS — CID 103062099

IUPAC[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine
SMILESCOCCCSCc1cnc(NN)cn1
InChIInChI=1S/C9H16N4OS/c1-14-3-2-4-15-7-8-5-12-9(13-10)6-11-8/h5-6H,2-4,7,10H2,1H3,(H,12,13)
InChIKeyRRETZZATFVKRIZ-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.03
Rot. Bonds7

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

[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine (PubChem CID 103062099) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine
PubChem CID103062099
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine
SMILESCOCCCSCc1cnc(NN)cn1
InChIInChI=1S/C9H16N4OS/c1-14-3-2-4-15-7-8-5-12-9(13-10)6-11-8/h5-6H,2-4,7,10H2,1H3,(H,12,13)
InChIKeyRRETZZATFVKRIZ-UHFFFAOYSA-N
XLogP1.03
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[5-(3-methylbutylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 107756789
[5-(2-methylpropylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062043
N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine
CID 103060605
[5-[(3,5-dimethylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062114
tert-butyl 2-[(5-hydrazinylpyrazin-2-yl)methylsulfanyl]acetate
CID 103062127
5-(3-methoxypropylsulfanylmethyl)-N-propylpyridin-2-amine
CID 63857257
[5-(3-methylbutan-2-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 107756750
[5-[(3-methylphenyl)methylsulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062082
4-(3-methoxypropylsulfanylmethyl)-1,3-thiazol-2-amine
CID 63857547
(5-propylpyrazin-2-yl)hydrazine
CID 123407613
[5-[(3-methoxyphenyl)sulfanylmethyl]pyrazin-2-yl]hydrazine
CID 103062018
methyl 3-[[5-(ethylamino)pyrazin-2-yl]methylsulfanyl]propanoate
CID 103059937

Frequently Asked Questions

What is the IUPAC name of [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The IUPAC name of [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine (CID 103062099) is [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine is COCCCSCc1cnc(NN)cn1.
What is the InChIKey of [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The InChIKey is RRETZZATFVKRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-14-3-2-4-15-7-8-5-12-9(13-10)6-11-8/h5-6H,2-4,7,10H2,1H3,(H,12,13).
What are the key properties of [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine?
[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine has a molecular weight of 228.32 g/mol, XLogP of 1.03, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103062099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).