N-ethylidenehydroxylamine;sulfane

C2H7NOS — CID 174747944

IUPACN-ethylidenehydroxylamine;sulfane
SMILESCC=NO.S
InChIInChI=1S/C2H5NO.H2S/c1-2-3-4;/h2,4H,1H3;1H2
InChIKeyRTMFRZPPIVTDSC-UHFFFAOYSA-N
MW93.15 g/mol
LogP0.58
Rot. Bonds

About N-ethylidenehydroxylamine;sulfane

N-ethylidenehydroxylamine;sulfane (PubChem CID 174747944) has the molecular formula C2H7NOS and a molecular weight of 93.15 g/mol. Its IUPAC name is N-ethylidenehydroxylamine;sulfane.

Molecular Properties

Compound NameN-ethylidenehydroxylamine;sulfane
PubChem CID174747944
Molecular FormulaC2H7NOS
Molecular Weight93.15 g/mol
Exact Mass93.02
IUPAC NameN-ethylidenehydroxylamine;sulfane
SMILESCC=NO.S
InChIInChI=1S/C2H5NO.H2S/c1-2-3-4;/h2,4H,1H3;1H2
InChIKeyRTMFRZPPIVTDSC-UHFFFAOYSA-N
XLogP0.58
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.15
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-ethylidenehydroxylamine;sulfane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethylidenehydroxylamine
CID 157067638
N-ethylidenehydroxylamine;nickel
CID 157374341
dichloromethane;N-ethylidenehydroxylamine
CID 174600671
(NE)-N-ethylidenehydroxylamine;sulfuric acid
CID 118485193
N-ethylidenehydroxylamine;4-methylbenzenethiol
CID 174830225
buta-1,3-diene;nitrous acid;prop-1-ene
CID 174689525
acetaldehyde;nitrous acid
CID 174522252
silver;(NE)-N-ethylidenehydroxylamine;2-hydroxy-2-methylbutanoate
CID 131974720
N-[(2E,4Z)-4-methylhepta-2,4,6-trien-3-yl]ethanimine
CID 146259127
benzoyl azide;(NE)-N-ethylidenehydroxylamine
CID 135184096
cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine
CID 174050213
N-oxidoethanimine
CID 14387232

Frequently Asked Questions

What is the IUPAC name of N-ethylidenehydroxylamine;sulfane?
The IUPAC name of N-ethylidenehydroxylamine;sulfane (CID 174747944) is N-ethylidenehydroxylamine;sulfane.
What is the SMILES notation for N-ethylidenehydroxylamine;sulfane?
The canonical SMILES for N-ethylidenehydroxylamine;sulfane is CC=NO.S.
What is the InChIKey of N-ethylidenehydroxylamine;sulfane?
The InChIKey is RTMFRZPPIVTDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5NO.H2S/c1-2-3-4;/h2,4H,1H3;1H2.
What are the key properties of N-ethylidenehydroxylamine;sulfane?
N-ethylidenehydroxylamine;sulfane has a molecular weight of 93.15 g/mol, XLogP of 0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylidenehydroxylamine;sulfane is sourced from PubChem (CID 174747944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).