1-(2-sulfinohydrazinyl)pentane

C5H14N2O2S — CID 90384129

IUPAC1-(2-sulfinohydrazinyl)pentane
SMILESCCCCCNNS(=O)O
InChIInChI=1S/C5H14N2O2S/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3,(H,8,9)
InChIKeyUNQHHXPNPOGHMO-UHFFFAOYSA-N
MW166.25 g/mol
LogP0.41
Rot. Bonds6

About 1-(2-sulfinohydrazinyl)pentane

1-(2-sulfinohydrazinyl)pentane (PubChem CID 90384129) has the molecular formula C5H14N2O2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 1-(2-sulfinohydrazinyl)pentane.

Molecular Properties

Compound Name1-(2-sulfinohydrazinyl)pentane
PubChem CID90384129
Molecular FormulaC5H14N2O2S
Molecular Weight166.25 g/mol
Exact Mass166.08
IUPAC Name1-(2-sulfinohydrazinyl)pentane
SMILESCCCCCNNS(=O)O
InChIInChI=1S/C5H14N2O2S/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3,(H,8,9)
InChIKeyUNQHHXPNPOGHMO-UHFFFAOYSA-N
XLogP0.41
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(sulfinoamino)tetradecane
CID 57045520
1,2-diheptylhydrazine
CID 11195547
1-decyl-2-octylhydrazine
CID 154085192
1-pentyl-2-propylhydrazine
CID 20568459
1-butyl-2-octylhydrazine
CID 88598240
N'-pentylmethanesulfonohydrazide
CID 174799641
octylcarbamothioic S-acid
CID 25085683
1-hexadecyl-3-sulfonylurea
CID 87997477
ethane;N-undecylpropanamide
CID 155706114
acetic acid;1-octadecyl-2-propylhydrazine
CID 22323613
2-chloro-N-dotriacontylacetamide
CID 163206961
N,N'-diheptyloxamide
CID 3417538

Frequently Asked Questions

What is the IUPAC name of 1-(2-sulfinohydrazinyl)pentane?
The IUPAC name of 1-(2-sulfinohydrazinyl)pentane (CID 90384129) is 1-(2-sulfinohydrazinyl)pentane.
What is the SMILES notation for 1-(2-sulfinohydrazinyl)pentane?
The canonical SMILES for 1-(2-sulfinohydrazinyl)pentane is CCCCCNNS(=O)O.
What is the InChIKey of 1-(2-sulfinohydrazinyl)pentane?
The InChIKey is UNQHHXPNPOGHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3,(H,8,9).
What are the key properties of 1-(2-sulfinohydrazinyl)pentane?
1-(2-sulfinohydrazinyl)pentane has a molecular weight of 166.25 g/mol, XLogP of 0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-sulfinohydrazinyl)pentane is sourced from PubChem (CID 90384129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).