N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide

C8H12N2OS — CID 63373165

IUPACN-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCCC(=O)NCc1scnc1C
InChIInChI=1S/C8H12N2OS/c1-3-8(11)9-4-7-6(2)10-5-12-7/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyQIRHBJSMOUMBIR-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.48
Rot. Bonds3

About N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide

N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide (PubChem CID 63373165) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide.

Molecular Properties

Compound NameN-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
PubChem CID63373165
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC NameN-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
SMILESCCC(=O)NCc1scnc1C
InChIInChI=1S/C8H12N2OS/c1-3-8(11)9-4-7-6(2)10-5-12-7/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyQIRHBJSMOUMBIR-UHFFFAOYSA-N
XLogP1.48
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-[(4-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 63681267
4-[(4-methyl-1,3-thiazol-5-yl)methylamino]-4-oxobutanoic acid
CID 63280743
1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-propylurea
CID 115612251
2-[2-[(4-methyl-1,3-thiazol-5-yl)methylamino]-2-oxoethoxy]acetic acid
CID 63281019
2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 63373273
2-anilino-N-[(4-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 63281191
N-[(4-methyl-1,3-thiazol-5-yl)methyl]prop-2-ynamide
CID 131203570
(2R)-2-hydroxy-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 130609015
5-amino-4-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pentanamide
CID 82012439
2-(3-amino-1,2,4-triazol-1-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 63280307
2-methyl-3-[(4-methyl-1,3-thiazol-5-yl)methylamino]-3-oxopropanoic acid
CID 114898424
3-(4-aminophenoxy)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 63279966

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The IUPAC name of N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide (CID 63373165) is N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide.
What is the SMILES notation for N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The canonical SMILES for N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide is CCC(=O)NCc1scnc1C.
What is the InChIKey of N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
The InChIKey is QIRHBJSMOUMBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-3-8(11)9-4-7-6(2)10-5-12-7/h5H,3-4H2,1-2H3,(H,9,11).
What are the key properties of N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide?
N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide has a molecular weight of 184.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide is sourced from PubChem (CID 63373165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).