N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

C10H18N2O3S — CID 107319006

IUPACN-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CSCC1=O)NCCCCCO
InChIInChI=1S/C10H18N2O3S/c13-5-3-1-2-4-11-9(14)6-12-8-16-7-10(12)15/h13H,1-8H2,(H,11,14)
InChIKeyIXVFCNUFYAFABB-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.20
Rot. Bonds7

About N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 107319006) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID107319006
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CSCC1=O)NCCCCCO
InChIInChI=1S/C10H18N2O3S/c13-5-3-1-2-4-11-9(14)6-12-8-16-7-10(12)15/h13H,1-8H2,(H,11,14)
InChIKeyIXVFCNUFYAFABB-UHFFFAOYSA-N
XLogP-0.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43354693
N-(4-hydroxybutyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 106843150
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]acetic acid
CID 43170515
N-[4-(4-fluorophenoxy)butyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 32643845
N-[4-(4-benzylpiperazin-1-yl)butyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 55934028
N-[2-(cycloheptylamino)ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 119621270
N-(2-cyclopropyl-2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 63295069
2-[[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]methyl]butanoic acid
CID 65217866
N'-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]cyclopropanecarbohydrazide
CID 51110368
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119514368
3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]-2-phenylpropanoic acid
CID 62884019
N-[(5-bromothiophen-2-yl)methyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 32775046

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 107319006) is N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is O=C(CN1CSCC1=O)NCCCCCO.
What is the InChIKey of N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is IXVFCNUFYAFABB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c13-5-3-1-2-4-11-9(14)6-12-8-16-7-10(12)15/h13H,1-8H2,(H,11,14).
What are the key properties of N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 246.33 g/mol, XLogP of -0.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 107319006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).