N-(2-aminoethyl)-2-(methanesulfonamido)acetamide

C5H13N3O3S — CID 56631162

IUPACN-(2-aminoethyl)-2-(methanesulfonamido)acetamide
SMILESCS(=O)(=O)NCC(=O)NCCN
InChIInChI=1S/C5H13N3O3S/c1-12(10,11)8-4-5(9)7-3-2-6/h8H,2-4,6H2,1H3,(H,7,9)
InChIKeyWYGNOPYDPDUBIR-UHFFFAOYSA-N
MW195.24 g/mol
LogP-2.39
Rot. Bonds5

About N-(2-aminoethyl)-2-(methanesulfonamido)acetamide

N-(2-aminoethyl)-2-(methanesulfonamido)acetamide (PubChem CID 56631162) has the molecular formula C5H13N3O3S and a molecular weight of 195.24 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(methanesulfonamido)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(methanesulfonamido)acetamide
PubChem CID56631162
Molecular FormulaC5H13N3O3S
Molecular Weight195.24 g/mol
Exact Mass195.07
IUPAC NameN-(2-aminoethyl)-2-(methanesulfonamido)acetamide
SMILESCS(=O)(=O)NCC(=O)NCCN
InChIInChI=1S/C5H13N3O3S/c1-12(10,11)8-4-5(9)7-3-2-6/h8H,2-4,6H2,1H3,(H,7,9)
InChIKeyWYGNOPYDPDUBIR-UHFFFAOYSA-N
XLogP-2.39
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 5-2.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(methanesulfonamido)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(methanesulfonamido)acetamide (CID 56631162) is N-(2-aminoethyl)-2-(methanesulfonamido)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(methanesulfonamido)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(methanesulfonamido)acetamide is CS(=O)(=O)NCC(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)-2-(methanesulfonamido)acetamide?
The InChIKey is WYGNOPYDPDUBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3O3S/c1-12(10,11)8-4-5(9)7-3-2-6/h8H,2-4,6H2,1H3,(H,7,9).
What are the key properties of N-(2-aminoethyl)-2-(methanesulfonamido)acetamide?
N-(2-aminoethyl)-2-(methanesulfonamido)acetamide has a molecular weight of 195.24 g/mol, XLogP of -2.39, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(methanesulfonamido)acetamide is sourced from PubChem (CID 56631162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).