[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine

C10H22N2O3S — CID 105321488

IUPAC[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine
SMILESCCCOCC(NN)C1CCCCS1(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-2-6-15-8-9(12-11)10-5-3-4-7-16(10,13)14/h9-10,12H,2-8,11H2,1H3
InChIKeyRNHZRVVHCRGIAS-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.21
Rot. Bonds6

About [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine

[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine (PubChem CID 105321488) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine
PubChem CID105321488
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine
SMILESCCCOCC(NN)C1CCCCS1(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-2-6-15-8-9(12-11)10-5-3-4-7-16(10,13)14/h9-10,12H,2-8,11H2,1H3
InChIKeyRNHZRVVHCRGIAS-UHFFFAOYSA-N
XLogP0.21
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine
CID 105321290
1-(1,1-dioxothian-2-yl)-2-ethoxy-N-methylethanamine
CID 105008079
1-(1,1-dioxothian-2-yl)-N-methyldecan-1-amine
CID 115831653
[1-(3-methylcyclopentyl)-2-propoxyethyl]hydrazine
CID 105233064
[1-(1,1-dioxothian-2-yl)-2-phenylethyl]hydrazine
CID 105283171
[1-(oxan-4-yl)-2-propoxyethyl]hydrazine
CID 105209961
1-(1,1-dioxothian-2-yl)-N-ethyloctan-1-amine
CID 115832238
1-(1,1-dioxothiolan-3-yl)-N-methyl-2-propoxyethanamine
CID 115336717
[2-(4-chlorophenyl)-1-(1,1-dioxothian-2-yl)ethyl]hydrazine
CID 105283336
[1-(1,1-dioxothian-2-yl)-2-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105292010
(1-cycloheptyl-3-propoxypropan-2-yl)hydrazine
CID 105321380
1-[5-(1,1-dioxothian-2-yl)-1,2,4-oxadiazol-3-yl]-2-propoxyethanamine
CID 104634466

Frequently Asked Questions

What is the IUPAC name of [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine?
The IUPAC name of [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine (CID 105321488) is [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine.
What is the SMILES notation for [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine?
The canonical SMILES for [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine is CCCOCC(NN)C1CCCCS1(=O)=O.
What is the InChIKey of [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine?
The InChIKey is RNHZRVVHCRGIAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-2-6-15-8-9(12-11)10-5-3-4-7-16(10,13)14/h9-10,12H,2-8,11H2,1H3.
What are the key properties of [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine?
[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine has a molecular weight of 250.36 g/mol, XLogP of 0.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine is sourced from PubChem (CID 105321488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).