N-(2-aminoethyl)methanesulfonamide

C6H20N4O4S2 — CID 158725113

IUPACN-(2-aminoethyl)methanesulfonamide
SMILESCS(=O)(=O)NCCN.CS(=O)(=O)NCCN
InChIInChI=1S/2C3H10N2O2S/c2*1-8(6,7)5-3-2-4/h2*5H,2-4H2,1H3
InChIKeyIKKCXRDJZFHXEE-UHFFFAOYSA-N
MW276.38 g/mol
LogP-3.01
Rot. Bonds6

About N-(2-aminoethyl)methanesulfonamide

N-(2-aminoethyl)methanesulfonamide (PubChem CID 158725113) has the molecular formula C6H20N4O4S2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-aminoethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)methanesulfonamide
PubChem CID158725113
Molecular FormulaC6H20N4O4S2
Molecular Weight276.38 g/mol
Exact Mass276.09
IUPAC NameN-(2-aminoethyl)methanesulfonamide
SMILESCS(=O)(=O)NCCN.CS(=O)(=O)NCCN
InChIInChI=1S/2C3H10N2O2S/c2*1-8(6,7)5-3-2-4/h2*5H,2-4H2,1H3
InChIKeyIKKCXRDJZFHXEE-UHFFFAOYSA-N
XLogP-3.01
TPSA144.38 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 5-3.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-aminoethyl)methanesulfonamide;hydrochloride
CID 22609809
N-(3-aminopropyl)methanesulfonamide
CID 18350602
N-(2-aminoethyl)methanesulfonamide;N-propylacetamide
CID 161235509
N-(2-hydroxyethyl)methanesulfonamide
CID 11389425
ethane-1,2-diamine;methanesulfonic acid
CID 161046577
4-(2-aminoethyl)-N-[2-(methanesulfonamido)ethyl]benzenesulfonamide
CID 79185763
N-(2-aminoethyl)-1,1-difluoromethanesulfonamide
CID 28606994
methane;N-[3-(methylamino)propyl]methanesulfonamide
CID 157130304
N-[2-[2-(methanesulfonamido)ethyl-methylsulfonylamino]ethyl]methanesulfonamide
CID 141436059
N-(5-amino-2,2-dimethylpentyl)methanesulfonamide
CID 106141702
3-(methanesulfonamido)propylthiourea
CID 106335651
N-(2-aminoethyl)-2-ethylbutane-1-sulfonamide
CID 119960084

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)methanesulfonamide?
The IUPAC name of N-(2-aminoethyl)methanesulfonamide (CID 158725113) is N-(2-aminoethyl)methanesulfonamide.
What is the SMILES notation for N-(2-aminoethyl)methanesulfonamide?
The canonical SMILES for N-(2-aminoethyl)methanesulfonamide is CS(=O)(=O)NCCN.CS(=O)(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)methanesulfonamide?
The InChIKey is IKKCXRDJZFHXEE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H10N2O2S/c2*1-8(6,7)5-3-2-4/h2*5H,2-4H2,1H3.
What are the key properties of N-(2-aminoethyl)methanesulfonamide?
N-(2-aminoethyl)methanesulfonamide has a molecular weight of 276.38 g/mol, XLogP of -3.01, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)methanesulfonamide is sourced from PubChem (CID 158725113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).