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

C10H17N3O2S — CID 119514368

IUPAC2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESO=C(CN1CSCC1=O)NCC1CCCN1
InChIInChI=1S/C10H17N3O2S/c14-9(5-13-7-16-6-10(13)15)12-4-8-2-1-3-11-8/h8,11H,1-7H2,(H,12,14)
InChIKeyPBBLVYBYNNMFHC-UHFFFAOYSA-N
MW243.33 g/mol
LogP-0.61
Rot. Bonds4

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

2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide (PubChem CID 119514368) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
PubChem CID119514368
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC Name2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESO=C(CN1CSCC1=O)NCC1CCCN1
InChIInChI=1S/C10H17N3O2S/c14-9(5-13-7-16-6-10(13)15)12-4-8-2-1-3-11-8/h8,11H,1-7H2,(H,12,14)
InChIKeyPBBLVYBYNNMFHC-UHFFFAOYSA-N
XLogP-0.61
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-oxoazepan-1-yl)-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 119511838
2-(azocan-1-yl)-N-[[(2S)-pyrrolidin-2-yl]methyl]acetamide
CID 122562256
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]acetic acid
CID 43170515
2-chloro-N-(pyrrolidin-2-ylmethyl)acetamide
CID 71302527
3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43354693
N-(2-methylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 120600156
N-(5-hydroxypentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 107319006
N-(pyrrolidin-2-ylmethyl)-2-(triazol-1-yl)acetamide
CID 81478292
N-(pyrrolidin-2-ylmethyl)azepane-1-carboxamide
CID 79152562
4-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]pent-4-enamide
CID 177056000
2-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)acetamide
CID 112701289
2-tert-butylsulfanyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 62540759

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide (CID 119514368) is 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide is O=C(CN1CSCC1=O)NCC1CCCN1.
What is the InChIKey of 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The InChIKey is PBBLVYBYNNMFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c14-9(5-13-7-16-6-10(13)15)12-4-8-2-1-3-11-8/h8,11H,1-7H2,(H,12,14).
What are the key properties of 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide?
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide has a molecular weight of 243.33 g/mol, XLogP of -0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(pyrrolidin-2-ylmethyl)acetamide is sourced from PubChem (CID 119514368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).