1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium

C5H10NOSY- — CID 59215213

IUPAC1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium
SMILESCN=S1(=O)[CH-]CCC1.[Y]
InChIInChI=1S/C5H10NOS.Y/c1-6-8(7)4-2-3-5-8;/h4H,2-3,5H2,1H3;/q-1;
InChIKeySMICLNDSLHLKOH-UHFFFAOYSA-N
MW221.11 g/mol
LogP1.04
Rot. Bonds

About 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium

1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium (PubChem CID 59215213) has the molecular formula C5H10NOSY- and a molecular weight of 221.11 g/mol. Its IUPAC name is 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium.

Molecular Properties

Compound Name1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium
PubChem CID59215213
Molecular FormulaC5H10NOSY-
Molecular Weight221.11 g/mol
Exact Mass220.95
IUPAC Name1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium
SMILESCN=S1(=O)[CH-]CCC1.[Y]
InChIInChI=1S/C5H10NOS.Y/c1-6-8(7)4-2-3-5-8;/h4H,2-3,5H2,1H3;/q-1;
InChIKeySMICLNDSLHLKOH-UHFFFAOYSA-N
XLogP1.04
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.11
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium?
The IUPAC name of 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium (CID 59215213) is 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium.
What is the SMILES notation for 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium?
The canonical SMILES for 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium is CN=S1(=O)[CH-]CCC1.[Y].
What is the InChIKey of 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium?
The InChIKey is SMICLNDSLHLKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NOS.Y/c1-6-8(7)4-2-3-5-8;/h4H,2-3,5H2,1H3;/q-1;.
What are the key properties of 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium?
1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium has a molecular weight of 221.11 g/mol, XLogP of 1.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylimino-2,3,4,5-tetrahydrothiophen-5-ide 1-oxide;yttrium is sourced from PubChem (CID 59215213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).