N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide

C10H19NO2S — CID 11564774

IUPACN-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)N[C@H]1CC[C@@H]2C[C@@H]21
InChIInChI=1S/C10H19NO2S/c1-10(2,3)14(12,13)11-9-5-4-7-6-8(7)9/h7-9,11H,4-6H2,1-3H3/t7-,8+,9+/m1/s1
InChIKeyZLZNLGHDDQCIOT-VGMNWLOBSA-N
MW217.33 g/mol
LogP1.50
Rot. Bonds2

About N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide

N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide (PubChem CID 11564774) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide
PubChem CID11564774
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC NameN-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)N[C@H]1CC[C@@H]2C[C@@H]21
InChIInChI=1S/C10H19NO2S/c1-10(2,3)14(12,13)11-9-5-4-7-6-8(7)9/h7-9,11H,4-6H2,1-3H3/t7-,8+,9+/m1/s1
InChIKeyZLZNLGHDDQCIOT-VGMNWLOBSA-N
XLogP1.50
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(1S,2R,5S,6S)-6-phenyl-2-bicyclo[3.1.0]hexanyl]propane-2-sulfonamide
CID 101397493
2-methyl-N-(4-methylpyrrolidin-3-yl)propane-2-sulfonamide
CID 104826091
N-(2-cyclopropylcyclopropyl)propane-2-sulfonamide
CID 168726732
N-(1-cyclopropylethyl)bicyclo[3.1.0]hexan-2-amine
CID 130496523
2-(2-bicyclo[3.1.0]hexanylamino)-N-methylpropanamide
CID 130525408
N-(1-cyclobutylethyl)bicyclo[3.1.0]hexan-2-amine
CID 130500255
N-(3-methylcyclobutyl)bicyclo[3.1.0]hexan-2-amine
CID 130500238
N-(2,2,3,3-tetramethylcyclopropyl)bicyclo[3.1.0]hexan-2-amine
CID 130525471
N-(2,3-dimethylcyclobutyl)bicyclo[3.1.0]hexan-2-amine
CID 130659290
(2R)-2-(2-methylsulfonylethyl)bicyclo[3.1.0]hexane
CID 130336972
N-(4-tricyclo[5.3.1.03,9]undecanyl)cyclopropanesulfonamide
CID 122499352
N-(2-bicyclo[3.1.0]hexanyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 154869141

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide?
The IUPAC name of N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide (CID 11564774) is N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide.
What is the SMILES notation for N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide?
The canonical SMILES for N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide is CC(C)(C)S(=O)(=O)N[C@H]1CC[C@@H]2C[C@@H]21.
What is the InChIKey of N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide?
The InChIKey is ZLZNLGHDDQCIOT-VGMNWLOBSA-N. The full InChI is InChI=1S/C10H19NO2S/c1-10(2,3)14(12,13)11-9-5-4-7-6-8(7)9/h7-9,11H,4-6H2,1-3H3/t7-,8+,9+/m1/s1.
What are the key properties of N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide?
N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide has a molecular weight of 217.33 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S,5R)-2-bicyclo[3.1.0]hexanyl]-2-methylpropane-2-sulfonamide is sourced from PubChem (CID 11564774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).