N'-propan-2-yldodec-1-ene-1-sulfonohydrazide

C15H32N2O2S — CID 57223041

IUPACN'-propan-2-yldodec-1-ene-1-sulfonohydrazide
SMILESCCCCCCCCCCC=CS(=O)(=O)NNC(C)C
InChIInChI=1S/C15H32N2O2S/c1-4-5-6-7-8-9-10-11-12-13-14-20(18,19)17-16-15(2)3/h13-17H,4-12H2,1-3H3
InChIKeyJFUQOGMSDSLLJD-UHFFFAOYSA-N
MW304.50 g/mol
LogP3.86
Rot. Bonds13

About N'-propan-2-yldodec-1-ene-1-sulfonohydrazide

N'-propan-2-yldodec-1-ene-1-sulfonohydrazide (PubChem CID 57223041) has the molecular formula C15H32N2O2S and a molecular weight of 304.50 g/mol. Its IUPAC name is N'-propan-2-yldodec-1-ene-1-sulfonohydrazide.

Molecular Properties

Compound NameN'-propan-2-yldodec-1-ene-1-sulfonohydrazide
PubChem CID57223041
Molecular FormulaC15H32N2O2S
Molecular Weight304.50 g/mol
Exact Mass304.22
IUPAC NameN'-propan-2-yldodec-1-ene-1-sulfonohydrazide
SMILESCCCCCCCCCCC=CS(=O)(=O)NNC(C)C
InChIInChI=1S/C15H32N2O2S/c1-4-5-6-7-8-9-10-11-12-13-14-20(18,19)17-16-15(2)3/h13-17H,4-12H2,1-3H3
InChIKeyJFUQOGMSDSLLJD-UHFFFAOYSA-N
XLogP3.86
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-propan-2-yldodec-1-ene-1-sulfonohydrazide?
The IUPAC name of N'-propan-2-yldodec-1-ene-1-sulfonohydrazide (CID 57223041) is N'-propan-2-yldodec-1-ene-1-sulfonohydrazide.
What is the SMILES notation for N'-propan-2-yldodec-1-ene-1-sulfonohydrazide?
The canonical SMILES for N'-propan-2-yldodec-1-ene-1-sulfonohydrazide is CCCCCCCCCCC=CS(=O)(=O)NNC(C)C.
What is the InChIKey of N'-propan-2-yldodec-1-ene-1-sulfonohydrazide?
The InChIKey is JFUQOGMSDSLLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2S/c1-4-5-6-7-8-9-10-11-12-13-14-20(18,19)17-16-15(2)3/h13-17H,4-12H2,1-3H3.
What are the key properties of N'-propan-2-yldodec-1-ene-1-sulfonohydrazide?
N'-propan-2-yldodec-1-ene-1-sulfonohydrazide has a molecular weight of 304.50 g/mol, XLogP of 3.86, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propan-2-yldodec-1-ene-1-sulfonohydrazide is sourced from PubChem (CID 57223041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).