N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide

C10H20N2O2S — CID 58557074

IUPACN-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide
SMILESCC[C@@H]1C[C@H](NS(=O)(=O)C2CC2)C[C@@H]1N
InChIInChI=1S/C10H20N2O2S/c1-2-7-5-8(6-10(7)11)12-15(13,14)9-3-4-9/h7-10,12H,2-6,11H2,1H3/t7-,8+,10+/m1/s1
InChIKeyOVKVQOSFFOOSTE-WEDXCCLWSA-N
MW232.35 g/mol
LogP0.58
Rot. Bonds4

About N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide

N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide (PubChem CID 58557074) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide
PubChem CID58557074
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC NameN-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide
SMILESCC[C@@H]1C[C@H](NS(=O)(=O)C2CC2)C[C@@H]1N
InChIInChI=1S/C10H20N2O2S/c1-2-7-5-8(6-10(7)11)12-15(13,14)9-3-4-9/h7-10,12H,2-6,11H2,1H3/t7-,8+,10+/m1/s1
InChIKeyOVKVQOSFFOOSTE-WEDXCCLWSA-N
XLogP0.58
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide?
The IUPAC name of N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide (CID 58557074) is N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide?
The canonical SMILES for N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide is CC[C@@H]1C[C@H](NS(=O)(=O)C2CC2)C[C@@H]1N.
What is the InChIKey of N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide?
The InChIKey is OVKVQOSFFOOSTE-WEDXCCLWSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-2-7-5-8(6-10(7)11)12-15(13,14)9-3-4-9/h7-10,12H,2-6,11H2,1H3/t7-,8+,10+/m1/s1.
What are the key properties of N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide?
N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide has a molecular weight of 232.35 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,3S,4R)-3-amino-4-ethylcyclopentyl]cyclopropanesulfonamide is sourced from PubChem (CID 58557074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).