N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide

C18H24N2O3S — CID 109388958

IUPACN-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
SMILESCCc1nc(CCNC(=O)C(C)Oc2cccc(CO)c2)sc1C
InChIInChI=1S/C18H24N2O3S/c1-4-16-13(3)24-17(20-16)8-9-19-18(22)12(2)23-15-7-5-6-14(10-15)11-21/h5-7,10,12,21H,4,8-9,11H2,1-3H3,(H,19,22)
InChIKeyBPSVRUJRLJOAIH-UHFFFAOYSA-N
MW348.47 g/mol
LogP2.63
Rot. Bonds8

About N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide

N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide (PubChem CID 109388958) has the molecular formula C18H24N2O3S and a molecular weight of 348.47 g/mol. Its IUPAC name is N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide.

Molecular Properties

Compound NameN-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
PubChem CID109388958
Molecular FormulaC18H24N2O3S
Molecular Weight348.47 g/mol
Exact Mass348.15
IUPAC NameN-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
SMILESCCc1nc(CCNC(=O)C(C)Oc2cccc(CO)c2)sc1C
InChIInChI=1S/C18H24N2O3S/c1-4-16-13(3)24-17(20-16)8-9-19-18(22)12(2)23-15-7-5-6-14(10-15)11-21/h5-7,10,12,21H,4,8-9,11H2,1-3H3,(H,19,22)
InChIKeyBPSVRUJRLJOAIH-UHFFFAOYSA-N
XLogP2.63
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]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-[3-(hydroxymethyl)phenoxy]-N-[(6-methyl-2-pyridinyl)methyl]propanamide
CID 109388909
N-[(5-ethylthiophen-2-yl)methyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388890
1-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-3-[(3-methoxyphenyl)methyl]-2-methylguanidine
CID 111251597
N-benzyl-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388625
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 71910177
N-[3-(3-fluorophenyl)propyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388998
N-[2-(cyclohexen-1-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388806
2-[3-(hydroxymethyl)phenoxy]-N-(thiophen-2-ylmethyl)propanamide
CID 109388777
N-(3,4-dimethylphenyl)-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388671
1-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 110922351
2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide
CID 109388663
1-[2-(3-chlorophenyl)ethyl]-3-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-methylguanidine;hydroiodide
CID 111357805

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide?
The IUPAC name of N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide (CID 109388958) is N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide.
What is the SMILES notation for N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide?
The canonical SMILES for N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide is CCc1nc(CCNC(=O)C(C)Oc2cccc(CO)c2)sc1C.
What is the InChIKey of N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide?
The InChIKey is BPSVRUJRLJOAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3S/c1-4-16-13(3)24-17(20-16)8-9-19-18(22)12(2)23-15-7-5-6-14(10-15)11-21/h5-7,10,12,21H,4,8-9,11H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide?
N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide has a molecular weight of 348.47 g/mol, XLogP of 2.63, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]-2-[3-(hydroxymethyl)phenoxy]propanamide is sourced from PubChem (CID 109388958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).