N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide

C10H18N4O2S2 — CID 175905331

IUPACN'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide
SMILESC=CC(=O)NNCCSSCCNNC(=O)C=C
InChIInChI=1S/C10H18N4O2S2/c1-3-9(15)13-11-5-7-17-18-8-6-12-14-10(16)4-2/h3-4,11-12H,1-2,5-8H2,(H,13,15)(H,14,16)
InChIKeyKZFSWAOJFDXYRC-UHFFFAOYSA-N
MW290.41 g/mol
LogP-0.02
Rot. Bonds11

About N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide

N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide (PubChem CID 175905331) has the molecular formula C10H18N4O2S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide.

Molecular Properties

Compound NameN'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide
PubChem CID175905331
Molecular FormulaC10H18N4O2S2
Molecular Weight290.41 g/mol
Exact Mass290.09
IUPAC NameN'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide
SMILESC=CC(=O)NNCCSSCCNNC(=O)C=C
InChIInChI=1S/C10H18N4O2S2/c1-3-9(15)13-11-5-7-17-18-8-6-12-14-10(16)4-2/h3-4,11-12H,1-2,5-8H2,(H,13,15)(H,14,16)
InChIKeyKZFSWAOJFDXYRC-UHFFFAOYSA-N
XLogP-0.02
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 5-0.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide with MolForge

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Related Compounds

N'-(4-hydroxybutyl)prop-2-enehydrazide
CID 87129975
3-[2-(prop-2-enoylamino)ethyldisulfanyl]propanoic acid
CID 86146383
N-[2-[(prop-2-enoylamino)disulfanyl]ethyl]prop-2-enamide
CID 163682413
N-[2-(4-oxohex-5-enyldisulfanyl)ethyl]prop-2-enamide
CID 58570202
N'-(prop-2-enoylamino)prop-2-enehydrazide
CID 19028369
N'-methylprop-2-enehydrazide
CID 19086393
(2-prop-2-enoylhydrazinyl)methyl-tripropylazanium
CID 151071649
N-[4-(prop-2-enoylamino)butyl]prop-2-enamide
CID 11542941
N-(2-ethylsulfanylethyl)prop-2-enamide
CID 54468890
N-[12-(prop-2-enoylamino)dodecyl]prop-2-enamide;N-[9-(prop-2-enoylamino)nonyl]prop-2-enamide
CID 159527537
CID 173161904
CID 173161904
N'-(1-hydroxypropyl)prop-2-enehydrazide
CID 140549480

Frequently Asked Questions

What is the IUPAC name of N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide?
The IUPAC name of N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide (CID 175905331) is N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide.
What is the SMILES notation for N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide?
The canonical SMILES for N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide is C=CC(=O)NNCCSSCCNNC(=O)C=C.
What is the InChIKey of N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide?
The InChIKey is KZFSWAOJFDXYRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S2/c1-3-9(15)13-11-5-7-17-18-8-6-12-14-10(16)4-2/h3-4,11-12H,1-2,5-8H2,(H,13,15)(H,14,16).
What are the key properties of N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide?
N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide has a molecular weight of 290.41 g/mol, XLogP of -0.02, 11 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[2-(2-prop-2-enoylhydrazinyl)ethyldisulfanyl]ethyl]prop-2-enehydrazide is sourced from PubChem (CID 175905331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).