N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide

C5H10N2O2S — CID 118606326

IUPACN-[(2R)-1-cyanopropan-2-yl]methanesulfonamide
SMILESC[C@H](CC#N)NS(C)(=O)=O
InChIInChI=1S/C5H10N2O2S/c1-5(3-4-6)7-10(2,8)9/h5,7H,3H2,1-2H3/t5-/m1/s1
InChIKeyOLZPVKFWKBTGRV-RXMQYKEDSA-N
MW162.21 g/mol
LogP-0.16
Rot. Bonds3

About N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide

N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide (PubChem CID 118606326) has the molecular formula C5H10N2O2S and a molecular weight of 162.21 g/mol. Its IUPAC name is N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-1-cyanopropan-2-yl]methanesulfonamide
PubChem CID118606326
Molecular FormulaC5H10N2O2S
Molecular Weight162.21 g/mol
Exact Mass162.05
IUPAC NameN-[(2R)-1-cyanopropan-2-yl]methanesulfonamide
SMILESC[C@H](CC#N)NS(C)(=O)=O
InChIInChI=1S/C5H10N2O2S/c1-5(3-4-6)7-10(2,8)9/h5,7H,3H2,1-2H3/t5-/m1/s1
InChIKeyOLZPVKFWKBTGRV-RXMQYKEDSA-N
XLogP-0.16
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.21
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide?
The IUPAC name of N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide (CID 118606326) is N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide?
The canonical SMILES for N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide is C[C@H](CC#N)NS(C)(=O)=O.
What is the InChIKey of N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide?
The InChIKey is OLZPVKFWKBTGRV-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H10N2O2S/c1-5(3-4-6)7-10(2,8)9/h5,7H,3H2,1-2H3/t5-/m1/s1.
What are the key properties of N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide?
N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide has a molecular weight of 162.21 g/mol, XLogP of -0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-cyanopropan-2-yl]methanesulfonamide is sourced from PubChem (CID 118606326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).