N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide

C12H18N2O2S — CID 3206750

IUPACN-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
SMILESCC(C)(C)c1csc(NC(=O)C2CCCO2)n1
InChIInChI=1S/C12H18N2O2S/c1-12(2,3)9-7-17-11(13-9)14-10(15)8-5-4-6-16-8/h7-8H,4-6H2,1-3H3,(H,13,14,15)
InChIKeyIUVBXWLTPFLBIX-UHFFFAOYSA-N
MW254.35 g/mol
LogP2.56
Rot. Bonds2

About N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide

N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide (PubChem CID 3206750) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
PubChem CID3206750
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
SMILESCC(C)(C)c1csc(NC(=O)C2CCCO2)n1
InChIInChI=1S/C12H18N2O2S/c1-12(2,3)9-7-17-11(13-9)14-10(15)8-5-4-6-16-8/h7-8H,4-6H2,1-3H3,(H,13,14,15)
InChIKeyIUVBXWLTPFLBIX-UHFFFAOYSA-N
XLogP2.56
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-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-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide?
The IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide (CID 3206750) is N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide is CC(C)(C)c1csc(NC(=O)C2CCCO2)n1.
What is the InChIKey of N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide?
The InChIKey is IUVBXWLTPFLBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-12(2,3)9-7-17-11(13-9)14-10(15)8-5-4-6-16-8/h7-8H,4-6H2,1-3H3,(H,13,14,15).
What are the key properties of N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide?
N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-1,3-thiazol-2-yl)oxolane-2-carboxamide is sourced from PubChem (CID 3206750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).