CID 102169929

C3H6NOS — CID 102169929

IUPAC—
SMILESCS[CH]C(N)=O
InChIInChI=1S/C3H6NOS/c1-6-2-3(4)5/h2H,1H3,(H2,4,5)
InChIKeyRLGXAUQMMFEFOR-UHFFFAOYSA-N
MW104.15 g/mol
LogP-0.00
Rot. Bonds2

About CID 102169929

CID 102169929 (PubChem CID 102169929) has the molecular formula C3H6NOS and a molecular weight of 104.15 g/mol.

Molecular Properties

Compound NameCID 102169929
PubChem CID102169929
Molecular FormulaC3H6NOS
Molecular Weight104.15 g/mol
Exact Mass104.02
IUPAC Name—
SMILESCS[CH]C(N)=O
InChIInChI=1S/C3H6NOS/c1-6-2-3(4)5/h2H,1H3,(H2,4,5)
InChIKeyRLGXAUQMMFEFOR-UHFFFAOYSA-N
XLogP-0.00
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.15
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 102169929?
The IUPAC name of CID 102169929 (CID 102169929) is not available.
What is the SMILES notation for CID 102169929?
The canonical SMILES for CID 102169929 is CS[CH]C(N)=O.
What is the InChIKey of CID 102169929?
The InChIKey is RLGXAUQMMFEFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6NOS/c1-6-2-3(4)5/h2H,1H3,(H2,4,5).
What are the key properties of CID 102169929?
CID 102169929 has a molecular weight of 104.15 g/mol, XLogP of -0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102169929 is sourced from PubChem (CID 102169929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).