CID 164685641

C6H11O2S — CID 164685641

IUPAC—
SMILESO=[S](=O)C1CCCCC1
InChIInChI=1S/C6H11O2S/c7-9(8)6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyPIZYNARBOTUWCX-UHFFFAOYSA-N
MW147.22 g/mol
LogP1.20
Rot. Bonds1

About CID 164685641

CID 164685641 (PubChem CID 164685641) has the molecular formula C6H11O2S and a molecular weight of 147.22 g/mol.

Molecular Properties

Compound NameCID 164685641
PubChem CID164685641
Molecular FormulaC6H11O2S
Molecular Weight147.22 g/mol
Exact Mass147.05
IUPAC Name—
SMILESO=[S](=O)C1CCCCC1
InChIInChI=1S/C6H11O2S/c7-9(8)6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyPIZYNARBOTUWCX-UHFFFAOYSA-N
XLogP1.20
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 164685641?
The IUPAC name of CID 164685641 (CID 164685641) is not available.
What is the SMILES notation for CID 164685641?
The canonical SMILES for CID 164685641 is O=[S](=O)C1CCCCC1.
What is the InChIKey of CID 164685641?
The InChIKey is PIZYNARBOTUWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11O2S/c7-9(8)6-4-2-1-3-5-6/h6H,1-5H2.
What are the key properties of CID 164685641?
CID 164685641 has a molecular weight of 147.22 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 164685641 is sourced from PubChem (CID 164685641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).