N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide

C14H20N2OS — CID 110793633

IUPACN-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1cc(C)c(CNC(=O)C2CSCN2)c(C)c1
InChIInChI=1S/C14H20N2OS/c1-9-4-10(2)12(11(3)5-9)6-15-14(17)13-7-18-8-16-13/h4-5,13,16H,6-8H2,1-3H3,(H,15,17)
InChIKeyFEWRZEQPDRWLIS-UHFFFAOYSA-N
MW264.39 g/mol
LogP1.89
Rot. Bonds3

About N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide

N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 110793633) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID110793633
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC NameN-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1cc(C)c(CNC(=O)C2CSCN2)c(C)c1
InChIInChI=1S/C14H20N2OS/c1-9-4-10(2)12(11(3)5-9)6-15-14(17)13-7-18-8-16-13/h4-5,13,16H,6-8H2,1-3H3,(H,15,17)
InChIKeyFEWRZEQPDRWLIS-UHFFFAOYSA-N
XLogP1.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide 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

N-[(4,5-dimethoxy-2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110794315
(4S)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 97014181
N-[(2,4,6-trimethylphenyl)methyl]azetidine-3-carboxamide
CID 115158841
N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110746243
N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 114956035
N-benzyl-1,3-thiazolidine-4-carboxamide
CID 24693076
(4R)-N-[(2-ethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 141124535
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61021789
N-[(5-chloro-4-methoxy-2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793934
N-[(4-propylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793540
N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61016722
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 119891916

Frequently Asked Questions

What is the IUPAC name of N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide (CID 110793633) is N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide is Cc1cc(C)c(CNC(=O)C2CSCN2)c(C)c1.
What is the InChIKey of N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is FEWRZEQPDRWLIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-9-4-10(2)12(11(3)5-9)6-15-14(17)13-7-18-8-16-13/h4-5,13,16H,6-8H2,1-3H3,(H,15,17).
What are the key properties of N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide?
N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 264.39 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 110793633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).