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

C15H18N2OS — CID 110388497

IUPACN-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCc1ccc(NC(=O)CCc2nc(C)cs2)cc1
InChIInChI=1S/C15H18N2OS/c1-3-12-4-6-13(7-5-12)17-14(18)8-9-15-16-11(2)10-19-15/h4-7,10H,3,8-9H2,1-2H3,(H,17,18)
InChIKeySRJVCPXYEFDJIQ-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.59
Rot. Bonds5

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

N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 110388497) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID110388497
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC NameN-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide
SMILESCCc1ccc(NC(=O)CCc2nc(C)cs2)cc1
InChIInChI=1S/C15H18N2OS/c1-3-12-4-6-13(7-5-12)17-14(18)8-9-15-16-11(2)10-19-15/h4-7,10H,3,8-9H2,1-2H3,(H,17,18)
InChIKeySRJVCPXYEFDJIQ-UHFFFAOYSA-N
XLogP3.59
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-ethylphenyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110739218
3-(4-methyl-1,3-thiazol-2-yl)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 110388522
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-3-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 100659254
1-(4-ethylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)butyl]guanidine;hydroiodide
CID 111098804
3-(4-methyl-1,3-thiazol-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 110388516
N-(4-ethylphenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide
CID 110388631
N-(4-ethylphenyl)-3-thiophen-2-ylpropanamide
CID 70852355
4-[[2-(4-methyl-1,3-thiazol-2-yl)acetyl]amino]benzamide
CID 110484497
N-[4-[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-yl]phenyl]propanamide
CID 9422708
3-(4-methyl-1,3-thiazol-2-yl)-N-(3-phenylpropyl)propanamide
CID 110388471
N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
CID 110650032
2-[4-[3-(4-ethylphenyl)propanoylamino]phenyl]acetic acid
CID 45346474

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide (CID 110388497) is N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide is CCc1ccc(NC(=O)CCc2nc(C)cs2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is SRJVCPXYEFDJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-3-12-4-6-13(7-5-12)17-14(18)8-9-15-16-11(2)10-19-15/h4-7,10H,3,8-9H2,1-2H3,(H,17,18).
What are the key properties of N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide?
N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 274.39 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 110388497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).