N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide

C8H18N2O4S — CID 43416219

IUPACN-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)NCCO
InChIInChI=1S/C8H18N2O4S/c1-3-6-15(13,14)10-7(2)8(12)9-4-5-11/h7,10-11H,3-6H2,1-2H3,(H,9,12)
InChIKeyOWCDCDOTVQCXHB-UHFFFAOYSA-N
MW238.31 g/mol
LogP-1.19
Rot. Bonds7

About N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide

N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide (PubChem CID 43416219) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide
PubChem CID43416219
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)NCCO
InChIInChI=1S/C8H18N2O4S/c1-3-6-15(13,14)10-7(2)8(12)9-4-5-11/h7,10-11H,3-6H2,1-2H3,(H,9,12)
InChIKeyOWCDCDOTVQCXHB-UHFFFAOYSA-N
XLogP-1.19
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-1.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-hydroxypropyl]-2-(propylsulfonylamino)propanamide
CID 83032343
2-(2-chloroethylsulfonylamino)-N-propylpropanamide
CID 107651325
(2S)-2-(propylsulfonylamino)propanoic acid
CID 7130952
(2S)-2-hydroxy-3-[2-(propylsulfonylamino)propanoylamino]propanoic acid
CID 107833554
N-(3-hydroxy-4-methoxybutyl)-2-(propylsulfonylamino)propanamide
CID 103877484
N-(1-hydroxy-4-methylpentan-3-yl)-2-(propylsulfonylamino)propanamide
CID 103782266
2-[[2-[2-(propylsulfonylamino)propanoylamino]acetyl]amino]acetic acid
CID 43465477
N-[3-(hydroxymethyl)pentan-3-yl]-2-(propylsulfonylamino)propanamide
CID 55082542
N-(2-methoxyethoxy)-2-(propylsulfonylamino)propanamide
CID 79675663
3-methyl-2-[2-(propylsulfonylamino)propanoylamino]butanoic acid
CID 43354101
2-(3-aminopropylsulfonylamino)-N-ethylpropanamide
CID 61480140
N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide
CID 43573547

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide (CID 43416219) is N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide is CCCS(=O)(=O)NC(C)C(=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide?
The InChIKey is OWCDCDOTVQCXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-3-6-15(13,14)10-7(2)8(12)9-4-5-11/h7,10-11H,3-6H2,1-2H3,(H,9,12).
What are the key properties of N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide?
N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide has a molecular weight of 238.31 g/mol, XLogP of -1.19, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide is sourced from PubChem (CID 43416219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).