ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate

C13H14N2O2S — CID 1102806

IUPACethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate
SMILESCCOC(=O)Nc1sc(C)nc1-c1ccccc1
InChIInChI=1S/C13H14N2O2S/c1-3-17-13(16)15-12-11(14-9(2)18-12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,15,16)
InChIKeyIXKUYQKVBJOMNT-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.69
Rot. Bonds3

About ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate

ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate (PubChem CID 1102806) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate
PubChem CID1102806
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Nameethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate
SMILESCCOC(=O)Nc1sc(C)nc1-c1ccccc1
InChIInChI=1S/C13H14N2O2S/c1-3-17-13(16)15-12-11(14-9(2)18-12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,15,16)
InChIKeyIXKUYQKVBJOMNT-UHFFFAOYSA-N
XLogP3.69
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate 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-(2-amino-4-phenyl-1,3-thiazol-5-yl)acetamide
CID 904070
5-({[(Ethylamino)carbonyl]oxy}ethanimidoyl)-4-methyl-2-phenyl-1,3-thiazole
CID 9581921
methyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate
CID 811874
Ethyl (5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamate
CID 260048
N-(2,4-diphenyl-1,3-thiazol-5-yl)acetamide
CID 833380
N-(2,4-Diphenylthiazole-5-yl)-2,2,2-trifluoroacetamide
CID 11631624
N-(2,4-diphenyl-1,3-thiazol-5-yl)-2-propylpentanamide
CID 16116070
4-Methyl-2-phenyl-1,3-thiazol-5-amine
CID 62076990
propan-2-yl N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]propan-2-yl]carbamate
CID 168296038
N-(2-Cyclohexyl-4-phenylthiazole-5-yl)-2,2,2-trifluoroacetamide
CID 86239633
N-(2-Isopropyl-4-phenylthiazole-5-yl)-2,2,2-trifluoroacetamide
CID 86239638
tert-butyl N-(4-(4-fluorophenyl)-1,3-thiazol-5-yl)carbamate
CID 121552726

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate?
The IUPAC name of ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate (CID 1102806) is ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate.
What is the SMILES notation for ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate?
The canonical SMILES for ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate is CCOC(=O)Nc1sc(C)nc1-c1ccccc1.
What is the InChIKey of ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate?
The InChIKey is IXKUYQKVBJOMNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-3-17-13(16)15-12-11(14-9(2)18-12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,15,16).
What are the key properties of ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate?
ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate has a molecular weight of 262.33 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbamate is sourced from PubChem (CID 1102806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).