N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide

C8H13N3OS — CID 59190850

IUPACN-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN(C)C)s1
InChIInChI=1S/C8H13N3OS/c1-6(12)10-8-9-4-7(13-8)5-11(2)3/h4H,5H2,1-3H3,(H,9,10,12)
InChIKeyGSTVLZUBESBTHH-UHFFFAOYSA-N
MW199.28 g/mol
LogP1.16
Rot. Bonds3

About N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide

N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 59190850) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide
PubChem CID59190850
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC NameN-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN(C)C)s1
InChIInChI=1S/C8H13N3OS/c1-6(12)10-8-9-4-7(13-8)5-11(2)3/h4H,5H2,1-3H3,(H,9,10,12)
InChIKeyGSTVLZUBESBTHH-UHFFFAOYSA-N
XLogP1.16
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide 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-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide (CID 59190850) is N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(CN(C)C)s1.
What is the InChIKey of N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is GSTVLZUBESBTHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c1-6(12)10-8-9-4-7(13-8)5-11(2)3/h4H,5H2,1-3H3,(H,9,10,12).
What are the key properties of N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 199.28 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 59190850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).