(hydroxysulfonothioylamino)cyclopropane

C3H7NO2S2 — CID 88889019

IUPAC(hydroxysulfonothioylamino)cyclopropane
SMILESO=S(O)(=S)NC1CC1
InChIInChI=1S/C3H7NO2S2/c5-8(6,7)4-3-1-2-3/h3-4H,1-2H2,(H,5,6,7)
InChIKeyKTDYNXHVUZGFLI-UHFFFAOYSA-N
MW153.23 g/mol
LogP-0.13
Rot. Bonds2

About (hydroxysulfonothioylamino)cyclopropane

(hydroxysulfonothioylamino)cyclopropane (PubChem CID 88889019) has the molecular formula C3H7NO2S2 and a molecular weight of 153.23 g/mol. Its IUPAC name is (hydroxysulfonothioylamino)cyclopropane.

Molecular Properties

Compound Name(hydroxysulfonothioylamino)cyclopropane
PubChem CID88889019
Molecular FormulaC3H7NO2S2
Molecular Weight153.23 g/mol
Exact Mass152.99
IUPAC Name(hydroxysulfonothioylamino)cyclopropane
SMILESO=S(O)(=S)NC1CC1
InChIInChI=1S/C3H7NO2S2/c5-8(6,7)4-3-1-2-3/h3-4H,1-2H2,(H,5,6,7)
InChIKeyKTDYNXHVUZGFLI-UHFFFAOYSA-N
XLogP-0.13
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (hydroxysulfonothioylamino)cyclopropane?
The IUPAC name of (hydroxysulfonothioylamino)cyclopropane (CID 88889019) is (hydroxysulfonothioylamino)cyclopropane.
What is the SMILES notation for (hydroxysulfonothioylamino)cyclopropane?
The canonical SMILES for (hydroxysulfonothioylamino)cyclopropane is O=S(O)(=S)NC1CC1.
What is the InChIKey of (hydroxysulfonothioylamino)cyclopropane?
The InChIKey is KTDYNXHVUZGFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO2S2/c5-8(6,7)4-3-1-2-3/h3-4H,1-2H2,(H,5,6,7).
What are the key properties of (hydroxysulfonothioylamino)cyclopropane?
(hydroxysulfonothioylamino)cyclopropane has a molecular weight of 153.23 g/mol, XLogP of -0.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (hydroxysulfonothioylamino)cyclopropane is sourced from PubChem (CID 88889019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).