N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide

C19H19N3O2S — CID 24587710

IUPACN-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCCC2)=NC1=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H19N3O2S/c23-17(20-15-8-7-13-5-1-2-6-14(13)11-15)12-16-18(24)21-19(25-16)22-9-3-4-10-22/h1-2,5-8,11,16H,3-4,9-10,12H2,(H,20,23)
InChIKeyRRAJXDRVUKZFOS-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.26
Rot. Bonds3

About N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide

N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide (PubChem CID 24587710) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
PubChem CID24587710
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC NameN-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCCC2)=NC1=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H19N3O2S/c23-17(20-15-8-7-13-5-1-2-6-14(13)11-15)12-16-18(24)21-19(25-16)22-9-3-4-10-22/h1-2,5-8,11,16H,3-4,9-10,12H2,(H,20,23)
InChIKeyRRAJXDRVUKZFOS-UHFFFAOYSA-N
XLogP3.26
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide (CID 24587710) is N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide is O=C(CC1SC(N2CCCC2)=NC1=O)Nc1ccc2ccccc2c1.
What is the InChIKey of N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The InChIKey is RRAJXDRVUKZFOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c23-17(20-15-8-7-13-5-1-2-6-14(13)11-15)12-16-18(24)21-19(25-16)22-9-3-4-10-22/h1-2,5-8,11,16H,3-4,9-10,12H2,(H,20,23).
What are the key properties of N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide has a molecular weight of 353.45 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 24587710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).