N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide

C9H19NO5S — CID 115772770

IUPACN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide
SMILESCOCCN(CCO)C(=O)C(C)S(C)(=O)=O
InChIInChI=1S/C9H19NO5S/c1-8(16(3,13)14)9(12)10(4-6-11)5-7-15-2/h8,11H,4-7H2,1-3H3
InChIKeyNQAMLPQSBZEULI-UHFFFAOYSA-N
MW253.32 g/mol
LogP-1.11
Rot. Bonds7

About N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide

N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide (PubChem CID 115772770) has the molecular formula C9H19NO5S and a molecular weight of 253.32 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide
PubChem CID115772770
Molecular FormulaC9H19NO5S
Molecular Weight253.32 g/mol
Exact Mass253.10
IUPAC NameN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide
SMILESCOCCN(CCO)C(=O)C(C)S(C)(=O)=O
InChIInChI=1S/C9H19NO5S/c1-8(16(3,13)14)9(12)10(4-6-11)5-7-15-2/h8,11H,4-7H2,1-3H3
InChIKeyNQAMLPQSBZEULI-UHFFFAOYSA-N
XLogP-1.11
TPSA83.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-bis(2-hydroxyethyl)-2-methylsulfonylpropanamide
CID 115772414
2,2-difluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)acetamide
CID 103513987
(2S)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-3-methylpentanamide
CID 104861622
(2R)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-methylpentanamide
CID 104904000
3,3,3-trifluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-(trifluoromethyl)propanamide
CID 103310231
N,N-bis(2-chloroethyl)-2-methylsulfonylpropanamide
CID 104520204
(2R)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pentanamide
CID 107570616
(2S)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pentanamide
CID 107570615
N-benzyl-N-(2-hydroxyethyl)-2-methylsulfonylpropanamide
CID 115582885
2-(4-fluorophenyl)sulfonyl-N,N-bis(2-methoxyethyl)propanamide
CID 55739528
(2S)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-phenylbutanamide
CID 104984805
2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)propanamide
CID 103915709

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide (CID 115772770) is N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide is COCCN(CCO)C(=O)C(C)S(C)(=O)=O.
What is the InChIKey of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide?
The InChIKey is NQAMLPQSBZEULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO5S/c1-8(16(3,13)14)9(12)10(4-6-11)5-7-15-2/h8,11H,4-7H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide?
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide has a molecular weight of 253.32 g/mol, XLogP of -1.11, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylsulfonylpropanamide is sourced from PubChem (CID 115772770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).