N-(4-aminobutyl)cyclopropanesulfonamide

C7H16N2O2S — CID 64553014

IUPACN-(4-aminobutyl)cyclopropanesulfonamide
SMILESNCCCCNS(=O)(=O)C1CC1
InChIInChI=1S/C7H16N2O2S/c8-5-1-2-6-9-12(10,11)7-3-4-7/h7,9H,1-6,8H2
InChIKeyYLLDGKYZDKSOGA-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.19
Rot. Bonds6

About N-(4-aminobutyl)cyclopropanesulfonamide

N-(4-aminobutyl)cyclopropanesulfonamide (PubChem CID 64553014) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-(4-aminobutyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(4-aminobutyl)cyclopropanesulfonamide
PubChem CID64553014
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-(4-aminobutyl)cyclopropanesulfonamide
SMILESNCCCCNS(=O)(=O)C1CC1
InChIInChI=1S/C7H16N2O2S/c8-5-1-2-6-9-12(10,11)7-3-4-7/h7,9H,1-6,8H2
InChIKeyYLLDGKYZDKSOGA-UHFFFAOYSA-N
XLogP-0.19
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminobutyl)cyclopropanesulfonamide?
The IUPAC name of N-(4-aminobutyl)cyclopropanesulfonamide (CID 64553014) is N-(4-aminobutyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(4-aminobutyl)cyclopropanesulfonamide?
The canonical SMILES for N-(4-aminobutyl)cyclopropanesulfonamide is NCCCCNS(=O)(=O)C1CC1.
What is the InChIKey of N-(4-aminobutyl)cyclopropanesulfonamide?
The InChIKey is YLLDGKYZDKSOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c8-5-1-2-6-9-12(10,11)7-3-4-7/h7,9H,1-6,8H2.
What are the key properties of N-(4-aminobutyl)cyclopropanesulfonamide?
N-(4-aminobutyl)cyclopropanesulfonamide has a molecular weight of 192.28 g/mol, XLogP of -0.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminobutyl)cyclopropanesulfonamide is sourced from PubChem (CID 64553014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).