N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide

C11H17N3OS — CID 63005488

IUPACN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
SMILESCCc1nc(NC(=O)C2CCNC2)sc1C
InChIInChI=1S/C11H17N3OS/c1-3-9-7(2)16-11(13-9)14-10(15)8-4-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyGBYNOCYSTJLAMM-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.56
Rot. Bonds3

About N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide (PubChem CID 63005488) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
PubChem CID63005488
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
SMILESCCc1nc(NC(=O)C2CCNC2)sc1C
InChIInChI=1S/C11H17N3OS/c1-3-9-7(2)16-11(13-9)14-10(15)8-4-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyGBYNOCYSTJLAMM-UHFFFAOYSA-N
XLogP1.56
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide (CID 63005488) is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide is CCc1nc(NC(=O)C2CCNC2)sc1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide?
The InChIKey is GBYNOCYSTJLAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-3-9-7(2)16-11(13-9)14-10(15)8-4-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15).
What are the key properties of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide?
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63005488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).