[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine

C10H18N4S2 — CID 105259576

IUPAC[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCC1SCCSC1C(NN)c1nccn1C
InChIInChI=1S/C10H18N4S2/c1-7-9(16-6-5-15-7)8(13-11)10-12-3-4-14(10)2/h3-4,7-9,13H,5-6,11H2,1-2H3
InChIKeyXFISAWKORKTNGM-UHFFFAOYSA-N
MW258.42 g/mol
LogP1.16
Rot. Bonds3

About [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine

[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine (PubChem CID 105259576) has the molecular formula C10H18N4S2 and a molecular weight of 258.42 g/mol. Its IUPAC name is [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
PubChem CID105259576
Molecular FormulaC10H18N4S2
Molecular Weight258.42 g/mol
Exact Mass258.10
IUPAC Name[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCC1SCCSC1C(NN)c1nccn1C
InChIInChI=1S/C10H18N4S2/c1-7-9(16-6-5-15-7)8(13-11)10-12-3-4-14(10)2/h3-4,7-9,13H,5-6,11H2,1-2H3
InChIKeyXFISAWKORKTNGM-UHFFFAOYSA-N
XLogP1.16
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.42
LogP ≤ 51.16
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

[(1-methylimidazol-2-yl)-spiro[2.2]pentan-2-ylmethyl]hydrazine
CID 164651893
bis(1-methylimidazol-2-yl)methylhydrazine
CID 105258117
[(3,5-difluorophenyl)-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
CID 105259663
[(3-methyl-1,4-dithian-2-yl)-thiophen-3-ylmethyl]hydrazine
CID 105259470
[(1-methylimidazol-2-yl)-(oxan-3-yl)methyl]hydrazine
CID 105229949
[(1-methylimidazol-2-yl)-(4-methylmorpholin-2-yl)methyl]hydrazine
CID 105244400
[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105261259
[(3-bromofuran-2-yl)-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
CID 105259746
[3,4-dihydro-1H-isochromen-1-yl-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308335
(1-methylimidazol-2-yl)-(thian-2-yl)methanol
CID 80622450
[2-cyclohexyl-1-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105258081
[(1-methylimidazol-2-yl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203671

Frequently Asked Questions

What is the IUPAC name of [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The IUPAC name of [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine (CID 105259576) is [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine is CC1SCCSC1C(NN)c1nccn1C.
What is the InChIKey of [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The InChIKey is XFISAWKORKTNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S2/c1-7-9(16-6-5-15-7)8(13-11)10-12-3-4-14(10)2/h3-4,7-9,13H,5-6,11H2,1-2H3.
What are the key properties of [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
[(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine has a molecular weight of 258.42 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-methyl-1,4-dithian-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 105259576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).