N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide

C12H18N2O2S — CID 45251203

IUPACN-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide
SMILESCc1nc(CCNC(=O)C2CCCO2)sc1C
InChIInChI=1S/C12H18N2O2S/c1-8-9(2)17-11(14-8)5-6-13-12(15)10-4-3-7-16-10/h10H,3-7H2,1-2H3,(H,13,15)
InChIKeyHJDRYVAXMHWWKA-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.60
Rot. Bonds4

About N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide

N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide (PubChem CID 45251203) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide
PubChem CID45251203
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide
SMILESCc1nc(CCNC(=O)C2CCCO2)sc1C
InChIInChI=1S/C12H18N2O2S/c1-8-9(2)17-11(14-8)5-6-13-12(15)10-4-3-7-16-10/h10H,3-7H2,1-2H3,(H,13,15)
InChIKeyHJDRYVAXMHWWKA-UHFFFAOYSA-N
XLogP1.60
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]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-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide?
The IUPAC name of N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide (CID 45251203) is N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide is Cc1nc(CCNC(=O)C2CCCO2)sc1C.
What is the InChIKey of N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide?
The InChIKey is HJDRYVAXMHWWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-8-9(2)17-11(14-8)5-6-13-12(15)10-4-3-7-16-10/h10H,3-7H2,1-2H3,(H,13,15).
What are the key properties of N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide?
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 45251203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).