N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide

C11H20N2O2S — CID 165458497

IUPACN-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide
SMILESNC1CC2CC(CNS(=O)(=O)C3CC3)CC12
InChIInChI=1S/C11H20N2O2S/c12-11-5-8-3-7(4-10(8)11)6-13-16(14,15)9-1-2-9/h7-11,13H,1-6,12H2
InChIKeyYCRJCZUIPUFXNV-UHFFFAOYSA-N
MW244.36 g/mol
LogP0.44
Rot. Bonds4

About N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide

N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide (PubChem CID 165458497) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide
PubChem CID165458497
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC NameN-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide
SMILESNC1CC2CC(CNS(=O)(=O)C3CC3)CC12
InChIInChI=1S/C11H20N2O2S/c12-11-5-8-3-7(4-10(8)11)6-13-16(14,15)9-1-2-9/h7-11,13H,1-6,12H2
InChIKeyYCRJCZUIPUFXNV-UHFFFAOYSA-N
XLogP0.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide?
The IUPAC name of N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide (CID 165458497) is N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide?
The canonical SMILES for N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide is NC1CC2CC(CNS(=O)(=O)C3CC3)CC12.
What is the InChIKey of N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide?
The InChIKey is YCRJCZUIPUFXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c12-11-5-8-3-7(4-10(8)11)6-13-16(14,15)9-1-2-9/h7-11,13H,1-6,12H2.
What are the key properties of N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide?
N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide has a molecular weight of 244.36 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-3-bicyclo[3.2.0]heptanyl)methyl]cyclopropanesulfonamide is sourced from PubChem (CID 165458497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).