2-(oxan-4-ylamino)ethanesulfonamide

C7H16N2O3S — CID 43608649

IUPAC2-(oxan-4-ylamino)ethanesulfonamide
SMILESNS(=O)(=O)CCNC1CCOCC1
InChIInChI=1S/C7H16N2O3S/c8-13(10,11)6-3-9-7-1-4-12-5-2-7/h7,9H,1-6H2,(H2,8,10,11)
InChIKeyZHRPHSQUZMDELM-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.96
Rot. Bonds4

About 2-(oxan-4-ylamino)ethanesulfonamide

2-(oxan-4-ylamino)ethanesulfonamide (PubChem CID 43608649) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is 2-(oxan-4-ylamino)ethanesulfonamide.

Molecular Properties

Compound Name2-(oxan-4-ylamino)ethanesulfonamide
PubChem CID43608649
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC Name2-(oxan-4-ylamino)ethanesulfonamide
SMILESNS(=O)(=O)CCNC1CCOCC1
InChIInChI=1S/C7H16N2O3S/c8-13(10,11)6-3-9-7-1-4-12-5-2-7/h7,9H,1-6H2,(H2,8,10,11)
InChIKeyZHRPHSQUZMDELM-UHFFFAOYSA-N
XLogP-0.96
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(oxan-4-ylamino)ethanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

2-n-Morpholine ethanesulfonic acid
CID 15787724
N-[2-[oxan-4-yl(propan-2-yl)amino]ethyl]ethanesulfonamide
CID 72003186
N-[2-[butan-2-yl(methyl)amino]ethyl]oxane-4-sulfonamide
CID 56803800
3-Methyl-1-(oxan-4-ylsulfonyl)piperazine
CID 65448066
2-(Oxan-4-ylamino)ethanesulfonate
CID 153294193
1-ethylsulfonyl-N-(oxan-4-yl)piperidin-4-amine
CID 43608586
N-[2-(oxan-4-ylamino)ethyl]methanesulfonamide
CID 43608588
2-amino-N-(oxan-4-yl)ethanesulfonamide
CID 43610045
N-(oxan-4-yl)piperidine-3-sulfonamide
CID 43610285
2-amino-N-methyl-N-(oxan-4-yl)ethanesulfonamide
CID 43610995
N-methyl-N-(oxan-4-yl)piperidine-3-sulfonamide
CID 43611264
N-(oxan-4-yl)-1-propylsulfonylpiperidin-4-amine
CID 43747936

Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-ylamino)ethanesulfonamide?
The IUPAC name of 2-(oxan-4-ylamino)ethanesulfonamide (CID 43608649) is 2-(oxan-4-ylamino)ethanesulfonamide.
What is the SMILES notation for 2-(oxan-4-ylamino)ethanesulfonamide?
The canonical SMILES for 2-(oxan-4-ylamino)ethanesulfonamide is NS(=O)(=O)CCNC1CCOCC1.
What is the InChIKey of 2-(oxan-4-ylamino)ethanesulfonamide?
The InChIKey is ZHRPHSQUZMDELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c8-13(10,11)6-3-9-7-1-4-12-5-2-7/h7,9H,1-6H2,(H2,8,10,11).
What are the key properties of 2-(oxan-4-ylamino)ethanesulfonamide?
2-(oxan-4-ylamino)ethanesulfonamide has a molecular weight of 208.28 g/mol, XLogP of -0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-ylamino)ethanesulfonamide is sourced from PubChem (CID 43608649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).