N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide

C7H14N2O3S — CID 71785455

IUPACN,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide
SMILESCN(C)C(=O)C1CN(S(C)(=O)=O)C1
InChIInChI=1S/C7H14N2O3S/c1-8(2)7(10)6-4-9(5-6)13(3,11)12/h6H,4-5H2,1-3H3
InChIKeyRUDMYCGKIKZBSG-UHFFFAOYSA-N
MW206.27 g/mol
LogP-1.03
Rot. Bonds2

About N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide

N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide (PubChem CID 71785455) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide
PubChem CID71785455
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC NameN,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide
SMILESCN(C)C(=O)C1CN(S(C)(=O)=O)C1
InChIInChI=1S/C7H14N2O3S/c1-8(2)7(10)6-4-9(5-6)13(3,11)12/h6H,4-5H2,1-3H3
InChIKeyRUDMYCGKIKZBSG-UHFFFAOYSA-N
XLogP-1.03
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-1.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide 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,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide?
The IUPAC name of N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide (CID 71785455) is N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide is CN(C)C(=O)C1CN(S(C)(=O)=O)C1.
What is the InChIKey of N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide?
The InChIKey is RUDMYCGKIKZBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-8(2)7(10)6-4-9(5-6)13(3,11)12/h6H,4-5H2,1-3H3.
What are the key properties of N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide?
N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide has a molecular weight of 206.27 g/mol, XLogP of -1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-methylsulfonylazetidine-3-carboxamide is sourced from PubChem (CID 71785455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).