2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide

C8H12N2OS — CID 2834959

IUPAC2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C)C(=O)Nc1nccs1
InChIInChI=1S/C8H12N2OS/c1-8(2,3)6(11)10-7-9-4-5-12-7/h4-5H,1-3H3,(H,9,10,11)
InChIKeyCISAFUJYQGBPLZ-UHFFFAOYSA-N
MW184.26 g/mol
LogP2.13
Rot. Bonds1

About 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide

2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 2834959) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide
PubChem CID2834959
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C)C(=O)Nc1nccs1
InChIInChI=1S/C8H12N2OS/c1-8(2,3)6(11)10-7-9-4-5-12-7/h4-5H,1-3H3,(H,9,10,11)
InChIKeyCISAFUJYQGBPLZ-UHFFFAOYSA-N
XLogP2.13
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-N-(1,3-thiazol-2-yl)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 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide (CID 2834959) is 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide is CC(C)(C)C(=O)Nc1nccs1.
What is the InChIKey of 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is CISAFUJYQGBPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-8(2,3)6(11)10-7-9-4-5-12-7/h4-5H,1-3H3,(H,9,10,11).
What are the key properties of 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide?
2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 184.26 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 2834959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).