3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide

C15H18N2O2S — CID 47378490

IUPAC3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCOc1ccc(CCC(=O)Nc2ncc(C)s2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-19-13-7-4-12(5-8-13)6-9-14(18)17-15-16-10-11(2)20-15/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18)
InChIKeyYDXAAQDPYDUNGR-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.42
Rot. Bonds6

About 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide

3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 47378490) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID47378490
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCOc1ccc(CCC(=O)Nc2ncc(C)s2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-19-13-7-4-12(5-8-13)6-9-14(18)17-15-16-10-11(2)20-15/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18)
InChIKeyYDXAAQDPYDUNGR-UHFFFAOYSA-N
XLogP3.42
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-ethoxyphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 3343017
3-(3-chloro-4-methylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 24555170
3-(4-ethoxyphenyl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]propanamide
CID 19226109
3-(4-ethoxyphenyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
CID 19229524
4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 47242346
3-(4-ethoxyphenyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide
CID 19226041
methyl 2-[3-(4-methylphenyl)propanoylamino]-1,3-thiazole-5-carboxylate
CID 18121924
N-(5-methyl-1,3-thiazol-2-yl)-4-oxopentanamide
CID 65416516
3-chloro-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 16795655
3-(4-ethoxyphenyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 19226097
4-(3,4-dimethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 145420181
3-(2-methoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 2102534

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide (CID 47378490) is 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide is CCOc1ccc(CCC(=O)Nc2ncc(C)s2)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is YDXAAQDPYDUNGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-3-19-13-7-4-12(5-8-13)6-9-14(18)17-15-16-10-11(2)20-15/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18).
What are the key properties of 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 290.39 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 47378490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).