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

C9H16N2O3S — CID 43418047

IUPACN-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(CO)NC(=O)CN1CSCC1=O
InChIInChI=1S/C9H16N2O3S/c1-2-7(4-12)10-8(13)3-11-6-15-5-9(11)14/h7,12H,2-6H2,1H3,(H,10,13)
InChIKeyYUTAAADFYNYPCV-UHFFFAOYSA-N
MW232.30 g/mol
LogP-0.59
Rot. Bonds5

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

N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 43418047) has the molecular formula C9H16N2O3S and a molecular weight of 232.30 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID43418047
Molecular FormulaC9H16N2O3S
Molecular Weight232.30 g/mol
Exact Mass232.09
IUPAC NameN-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(CO)NC(=O)CN1CSCC1=O
InChIInChI=1S/C9H16N2O3S/c1-2-7(4-12)10-8(13)3-11-6-15-5-9(11)14/h7,12H,2-6H2,1H3,(H,10,13)
InChIKeyYUTAAADFYNYPCV-UHFFFAOYSA-N
XLogP-0.59
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 60952485
N-(2-hydroxyethyl)-2-oxo-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 103915375
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-1,3-thiazolidine-4-carboxamide
CID 107479321
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 107483090
(4R)-3-(3-amino-2-hydroxypropyl)-N-tert-butyl-1,3-thiazolidine-4-carboxamide
CID 10038310
N-(4-hydroxybutyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 18961028
N-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 18961062
1-[4-(Hydroxymethyl)-2,2-dimethyl-1,3-thiazolidin-3-yl]-2-(methylamino)ethanone
CID 20699060
1-[4-(Hydroxymethyl)-1,3-thiazolidin-3-yl]-2-(methylamino)ethanone
CID 20699062
(4R)-N-[(1S)-1-Methyl-2-hydroxyethyl]-2-oxothiazolidin-4-yl-carboxamide
CID 21309140
2-(4-Hydroxy-2-oxo-5-propyl-1,3-thiazolidin-3-yl)propanamide
CID 25116147
(4R)-N-(2-Hydroxyethyl)-2-oxothiazolidine-4-carboxamide
CID 53943884

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 43418047) is N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CCC(CO)NC(=O)CN1CSCC1=O.
What is the InChIKey of N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is YUTAAADFYNYPCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3S/c1-2-7(4-12)10-8(13)3-11-6-15-5-9(11)14/h7,12H,2-6H2,1H3,(H,10,13).
What are the key properties of N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 232.30 g/mol, XLogP of -0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 43418047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).