N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide

C8H16N2O2S — CID 175950904

IUPACN-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide
SMILESC[C@H]1NC[C@@H]1CS(=O)(=O)NC1CC1
InChIInChI=1S/C8H16N2O2S/c1-6-7(4-9-6)5-13(11,12)10-8-2-3-8/h6-10H,2-5H2,1H3/t6-,7-/m1/s1
InChIKeyZXMQWROXAXUIEW-RNFRBKRXSA-N
MW204.29 g/mol
LogP-0.32
Rot. Bonds4

About N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide

N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide (PubChem CID 175950904) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide
PubChem CID175950904
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC NameN-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide
SMILESC[C@H]1NC[C@@H]1CS(=O)(=O)NC1CC1
InChIInChI=1S/C8H16N2O2S/c1-6-7(4-9-6)5-13(11,12)10-8-2-3-8/h6-10H,2-5H2,1H3/t6-,7-/m1/s1
InChIKeyZXMQWROXAXUIEW-RNFRBKRXSA-N
XLogP-0.32
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide?
The IUPAC name of N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide (CID 175950904) is N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide.
What is the SMILES notation for N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide?
The canonical SMILES for N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide is C[C@H]1NC[C@@H]1CS(=O)(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide?
The InChIKey is ZXMQWROXAXUIEW-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-6-7(4-9-6)5-13(11,12)10-8-2-3-8/h6-10H,2-5H2,1H3/t6-,7-/m1/s1.
What are the key properties of N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide?
N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide has a molecular weight of 204.29 g/mol, XLogP of -0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[(2R,3S)-2-methylazetidin-3-yl]methanesulfonamide is sourced from PubChem (CID 175950904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).