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

C11H19N3O2S — CID 119478713

IUPACN-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESNC1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C11H19N3O2S/c12-8-1-3-9(4-2-8)13-10(15)5-14-7-17-6-11(14)16/h8-9H,1-7,12H2,(H,13,15)
InChIKeyNYWMOKYHEHYEAN-UHFFFAOYSA-N
MW257.36 g/mol
LogP-0.09
Rot. Bonds3

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

N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 119478713) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID119478713
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESNC1CCC(NC(=O)CN2CSCC2=O)CC1
InChIInChI=1S/C11H19N3O2S/c12-8-1-3-9(4-2-8)13-10(15)5-14-7-17-6-11(14)16/h8-9H,1-7,12H2,(H,13,15)
InChIKeyNYWMOKYHEHYEAN-UHFFFAOYSA-N
XLogP-0.09
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47116849
N-(3-methylcyclopentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 114549925
N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47341054
N-(4-aminocyclohexyl)-2-(2-oxoazocan-1-yl)acetamide;hydrochloride
CID 119478869
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 47019402
N-(2-methylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 120600156
N'-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]cyclopropanecarbohydrazide
CID 51110368
N-[2-(cycloheptylamino)ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 119621270
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]acetic acid
CID 43170515
N-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 100851674
N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 112551088
N-(2-cyclopropyl-2-hydroxyethyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 63295069

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 119478713) is N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is NC1CCC(NC(=O)CN2CSCC2=O)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is NYWMOKYHEHYEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c12-8-1-3-9(4-2-8)13-10(15)5-14-7-17-6-11(14)16/h8-9H,1-7,12H2,(H,13,15).
What are the key properties of N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 257.36 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 119478713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).