N-(hydrazinesulfonyl)cyclopropanamine

C3H9N3O2S — CID 114807411

IUPACN-(hydrazinesulfonyl)cyclopropanamine
SMILESNNS(=O)(=O)NC1CC1
InChIInChI=1S/C3H9N3O2S/c4-6-9(7,8)5-3-1-2-3/h3,5-6H,1-2,4H2
InChIKeyKIRMLMCJTHMFFN-UHFFFAOYSA-N
MW151.19 g/mol
LogP-1.55
Rot. Bonds3

About N-(hydrazinesulfonyl)cyclopropanamine

N-(hydrazinesulfonyl)cyclopropanamine (PubChem CID 114807411) has the molecular formula C3H9N3O2S and a molecular weight of 151.19 g/mol. Its IUPAC name is N-(hydrazinesulfonyl)cyclopropanamine.

Molecular Properties

Compound NameN-(hydrazinesulfonyl)cyclopropanamine
PubChem CID114807411
Molecular FormulaC3H9N3O2S
Molecular Weight151.19 g/mol
Exact Mass151.04
IUPAC NameN-(hydrazinesulfonyl)cyclopropanamine
SMILESNNS(=O)(=O)NC1CC1
InChIInChI=1S/C3H9N3O2S/c4-6-9(7,8)5-3-1-2-3/h3,5-6H,1-2,4H2
InChIKeyKIRMLMCJTHMFFN-UHFFFAOYSA-N
XLogP-1.55
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(hydrazinesulfonyl)cyclopropanamine?
The IUPAC name of N-(hydrazinesulfonyl)cyclopropanamine (CID 114807411) is N-(hydrazinesulfonyl)cyclopropanamine.
What is the SMILES notation for N-(hydrazinesulfonyl)cyclopropanamine?
The canonical SMILES for N-(hydrazinesulfonyl)cyclopropanamine is NNS(=O)(=O)NC1CC1.
What is the InChIKey of N-(hydrazinesulfonyl)cyclopropanamine?
The InChIKey is KIRMLMCJTHMFFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N3O2S/c4-6-9(7,8)5-3-1-2-3/h3,5-6H,1-2,4H2.
What are the key properties of N-(hydrazinesulfonyl)cyclopropanamine?
N-(hydrazinesulfonyl)cyclopropanamine has a molecular weight of 151.19 g/mol, XLogP of -1.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(hydrazinesulfonyl)cyclopropanamine is sourced from PubChem (CID 114807411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).