N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

C9H16N2O4S — CID 61236011

IUPACN,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CSCC1=O)N(CCO)CCO
InChIInChI=1S/C9H16N2O4S/c12-3-1-10(2-4-13)8(14)5-11-7-16-6-9(11)15/h12-13H,1-7H2
InChIKeyHHWUQLIZJMTHNK-UHFFFAOYSA-N
MW248.30 g/mol
LogP-1.67
Rot. Bonds6

About N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 61236011) has the molecular formula C9H16N2O4S and a molecular weight of 248.30 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID61236011
Molecular FormulaC9H16N2O4S
Molecular Weight248.30 g/mol
Exact Mass248.08
IUPAC NameN,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CSCC1=O)N(CCO)CCO
InChIInChI=1S/C9H16N2O4S/c12-3-1-10(2-4-13)8(14)5-11-7-16-6-9(11)15/h12-13H,1-7H2
InChIKeyHHWUQLIZJMTHNK-UHFFFAOYSA-N
XLogP-1.67
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 5-1.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 61236011) is N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is O=C(CN1CSCC1=O)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is HHWUQLIZJMTHNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4S/c12-3-1-10(2-4-13)8(14)5-11-7-16-6-9(11)15/h12-13H,1-7H2.
What are the key properties of N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 248.30 g/mol, XLogP of -1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 61236011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).