N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide

C10H16N2OS — CID 47868743

IUPACN,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide
SMILESCN(Cc1cscn1)C(=O)C(C)(C)C
InChIInChI=1S/C10H16N2OS/c1-10(2,3)9(13)12(4)5-8-6-14-7-11-8/h6-7H,5H2,1-4H3
InChIKeyHLYDYPFDJSXDDS-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.15
Rot. Bonds2

About N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide

N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide (PubChem CID 47868743) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide
PubChem CID47868743
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide
SMILESCN(Cc1cscn1)C(=O)C(C)(C)C
InChIInChI=1S/C10H16N2OS/c1-10(2,3)9(13)12(4)5-8-6-14-7-11-8/h6-7H,5H2,1-4H3
InChIKeyHLYDYPFDJSXDDS-UHFFFAOYSA-N
XLogP2.15
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide 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,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide?
The IUPAC name of N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide (CID 47868743) is N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide.
What is the SMILES notation for N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide?
The canonical SMILES for N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide is CN(Cc1cscn1)C(=O)C(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide?
The InChIKey is HLYDYPFDJSXDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-10(2,3)9(13)12(4)5-8-6-14-7-11-8/h6-7H,5H2,1-4H3.
What are the key properties of N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide?
N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide has a molecular weight of 212.32 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-(1,3-thiazol-4-ylmethyl)propanamide is sourced from PubChem (CID 47868743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).