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

C10H18N2O3S — CID 65114982

IUPACN-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(C)(O)CNC(=O)CN1CSCC1=O
InChIInChI=1S/C10H18N2O3S/c1-3-10(2,15)6-11-8(13)4-12-7-16-5-9(12)14/h15H,3-7H2,1-2H3,(H,11,13)
InChIKeySFFSVPVOMREHRO-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.20
Rot. Bonds5

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

N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 65114982) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID65114982
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCC(C)(O)CNC(=O)CN1CSCC1=O
InChIInChI=1S/C10H18N2O3S/c1-3-10(2,15)6-11-8(13)4-12-7-16-5-9(12)14/h15H,3-7H2,1-2H3,(H,11,13)
InChIKeySFFSVPVOMREHRO-UHFFFAOYSA-N
XLogP-0.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N1-cyclopentyl-N2-(2-hydroxy-2-methyl-4-(methylthio)butyl)oxalamide
CID 71787370
N-[(1-hydroxycyclopentyl)methyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 64196688
[4-(2-Hydroxy-2-methylpropyl)piperazin-1-yl]-(1,3-thiazolidin-4-yl)methanone
CID 64338971
4-[4-(2-Hydroxy-2-methylpropyl)piperazine-1-carbonyl]-1,3-thiazolidin-2-one
CID 64341712
N-(3-hydroxybutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 64457750
N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 64556996
2-[(2-Hydroxy-2-methylbutyl)amino]-1-pyrrolidin-1-ylethanone
CID 65105993
N-(2-ethyl-2-hydroxybutyl)-1,3-thiazolidine-4-carboxamide
CID 65106512
N-(2-hydroxy-2-methylbutyl)-1,3-thiazolidine-4-carboxamide
CID 65106779
N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 65107502
N-(2-hydroxy-2-methylpropyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 65109815
N-(2-hydroxy-2-methylpropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 65110100

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 65114982) is N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CCC(C)(O)CNC(=O)CN1CSCC1=O.
What is the InChIKey of N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is SFFSVPVOMREHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c1-3-10(2,15)6-11-8(13)4-12-7-16-5-9(12)14/h15H,3-7H2,1-2H3,(H,11,13).
What are the key properties of N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 246.33 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylbutyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 65114982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).