[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine

C15H22N2OS2 — CID 105259732

IUPAC[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
SMILESCC1SCCSC1C(NN)c1cccc2c1OCCC2
InChIInChI=1S/C15H22N2OS2/c1-10-15(20-9-8-19-10)13(17-16)12-6-2-4-11-5-3-7-18-14(11)12/h2,4,6,10,13,15,17H,3,5,7-9,16H2,1H3
InChIKeyQJALGEFXDBILPC-UHFFFAOYSA-N
MW310.49 g/mol
LogP2.75
Rot. Bonds3

About [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine

[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine (PubChem CID 105259732) has the molecular formula C15H22N2OS2 and a molecular weight of 310.49 g/mol. Its IUPAC name is [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
PubChem CID105259732
Molecular FormulaC15H22N2OS2
Molecular Weight310.49 g/mol
Exact Mass310.12
IUPAC Name[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine
SMILESCC1SCCSC1C(NN)c1cccc2c1OCCC2
InChIInChI=1S/C15H22N2OS2/c1-10-15(20-9-8-19-10)13(17-16)12-6-2-4-11-5-3-7-18-14(11)12/h2,4,6,10,13,15,17H,3,5,7-9,16H2,1H3
InChIKeyQJALGEFXDBILPC-UHFFFAOYSA-N
XLogP2.75
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.49
LogP ≤ 52.75
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'}

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Related Compounds

1-(2,3-dihydro-1-benzofuran-7-yl)-N-methyl-1-(3-methyl-1,4-dithian-2-yl)methanamine
CID 114746006
[cyclohexyl(3,4-dihydro-2H-chromen-8-yl)methyl]hydrazine
CID 105201959
[3,4-dihydro-2H-chromen-8-yl-(3-methylcyclohexyl)methyl]hydrazine
CID 105210441
[(3-methyl-1,4-dithian-2-yl)-(2-methylphenyl)methyl]hydrazine
CID 105259440
[cycloheptyl(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105232138
[cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105201988
[1-(3,4-dihydro-2H-chromen-8-yl)-2-methylsulfanylethyl]hydrazine
CID 105214067
[1-(3,4-dihydro-2H-chromen-8-yl)-2-methoxybutyl]hydrazine
CID 105270858
[(3-methyl-1,4-dithian-2-yl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105259619
[3,4-dihydro-2H-chromen-8-yl-(2-ethylphenyl)methyl]hydrazine
CID 105340021
[2,3-dihydro-1-benzofuran-7-yl(oxan-3-yl)methyl]hydrazine
CID 105230130
N-[2,3-dihydro-1-benzofuran-7-yl(thian-2-yl)methyl]ethanamine
CID 114745936

Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine (CID 105259732) is [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine is CC1SCCSC1C(NN)c1cccc2c1OCCC2.
What is the InChIKey of [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine?
The InChIKey is QJALGEFXDBILPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS2/c1-10-15(20-9-8-19-10)13(17-16)12-6-2-4-11-5-3-7-18-14(11)12/h2,4,6,10,13,15,17H,3,5,7-9,16H2,1H3.
What are the key properties of [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine?
[3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine has a molecular weight of 310.49 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-chromen-8-yl-(3-methyl-1,4-dithian-2-yl)methyl]hydrazine is sourced from PubChem (CID 105259732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).