N-(2-azidoethyl)cyclopropanesulfonamide

C5H10N4O2S — CID 64553920

IUPACN-(2-azidoethyl)cyclopropanesulfonamide
SMILES[N-]=[N+]=NCCNS(=O)(=O)C1CC1
InChIInChI=1S/C5H10N4O2S/c6-9-7-3-4-8-12(10,11)5-1-2-5/h5,8H,1-4H2
InChIKeyIUUKYEQPCWNCSG-UHFFFAOYSA-N
MW190.23 g/mol
LogP0.38
Rot. Bonds5

About N-(2-azidoethyl)cyclopropanesulfonamide

N-(2-azidoethyl)cyclopropanesulfonamide (PubChem CID 64553920) has the molecular formula C5H10N4O2S and a molecular weight of 190.23 g/mol. Its IUPAC name is N-(2-azidoethyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-azidoethyl)cyclopropanesulfonamide
PubChem CID64553920
Molecular FormulaC5H10N4O2S
Molecular Weight190.23 g/mol
Exact Mass190.05
IUPAC NameN-(2-azidoethyl)cyclopropanesulfonamide
SMILES[N-]=[N+]=NCCNS(=O)(=O)C1CC1
InChIInChI=1S/C5H10N4O2S/c6-9-7-3-4-8-12(10,11)5-1-2-5/h5,8H,1-4H2
InChIKeyIUUKYEQPCWNCSG-UHFFFAOYSA-N
XLogP0.38
TPSA94.93 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.23
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-azidoethyl)cyclopropanesulfonamide?
The IUPAC name of N-(2-azidoethyl)cyclopropanesulfonamide (CID 64553920) is N-(2-azidoethyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-azidoethyl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-azidoethyl)cyclopropanesulfonamide is [N-]=[N+]=NCCNS(=O)(=O)C1CC1.
What is the InChIKey of N-(2-azidoethyl)cyclopropanesulfonamide?
The InChIKey is IUUKYEQPCWNCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O2S/c6-9-7-3-4-8-12(10,11)5-1-2-5/h5,8H,1-4H2.
What are the key properties of N-(2-azidoethyl)cyclopropanesulfonamide?
N-(2-azidoethyl)cyclopropanesulfonamide has a molecular weight of 190.23 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-azidoethyl)cyclopropanesulfonamide is sourced from PubChem (CID 64553920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).