[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine

C15H24N2O2S2 — CID 103347267

IUPAC[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)C2CSC(C)C(C)S2)c1
InChIInChI=1S/C15H24N2O2S2/c1-9-10(2)21-14(8-20-9)15(17-16)11-5-12(18-3)7-13(6-11)19-4/h5-7,9-10,14-15,17H,8,16H2,1-4H3
InChIKeyKDPGULZCUVIJJZ-UHFFFAOYSA-N
MW328.50 g/mol
LogP2.83
Rot. Bonds5

About [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine

[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine (PubChem CID 103347267) has the molecular formula C15H24N2O2S2 and a molecular weight of 328.50 g/mol. Its IUPAC name is [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine
PubChem CID103347267
Molecular FormulaC15H24N2O2S2
Molecular Weight328.50 g/mol
Exact Mass328.13
IUPAC Name[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)C2CSC(C)C(C)S2)c1
InChIInChI=1S/C15H24N2O2S2/c1-9-10(2)21-14(8-20-9)15(17-16)11-5-12(18-3)7-13(6-11)19-4/h5-7,9-10,14-15,17H,8,16H2,1-4H3
InChIKeyKDPGULZCUVIJJZ-UHFFFAOYSA-N
XLogP2.83
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.50
LogP ≤ 52.83
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

[(5,6-dimethyl-1,4-dithian-2-yl)-(4-ethoxyphenyl)methyl]hydrazine
CID 103347176
[(5,6-dimethyl-1,4-dithian-2-yl)-(2-methoxyphenyl)methyl]hydrazine
CID 103347185
[(5,6-dimethyl-1,4-dithian-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 103347136
N-[(5,6-dimethyl-1,4-dithian-2-yl)-(2-fluoro-4-methoxyphenyl)methyl]ethanamine
CID 103395932
[cyclooctyl-(3,5-dimethoxyphenyl)methyl]hydrazine
CID 105255192
[(5,6-dimethyl-1,4-dithian-2-yl)-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
CID 106884464
[(2,3-difluoro-4-methylphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine
CID 107516548
3-[(5,6-dimethyl-1,4-dithian-2-yl)-hydrazinylmethyl]pyridin-4-amine
CID 103347226
1-(2,6-dimethoxyphenyl)-1-(5,6-dimethyl-1,4-dithian-2-yl)-N-methylmethanamine
CID 103345808
[1,4-dithian-2-yl-(4-methoxyphenyl)methyl]hydrazine
CID 105249296
[(4-methoxyphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255443
[(4,4-difluorocyclohexyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
CID 105323920

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine (CID 103347267) is [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine is COc1cc(OC)cc(C(NN)C2CSC(C)C(C)S2)c1.
What is the InChIKey of [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine?
The InChIKey is KDPGULZCUVIJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S2/c1-9-10(2)21-14(8-20-9)15(17-16)11-5-12(18-3)7-13(6-11)19-4/h5-7,9-10,14-15,17H,8,16H2,1-4H3.
What are the key properties of [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine?
[(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine has a molecular weight of 328.50 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methyl]hydrazine is sourced from PubChem (CID 103347267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).