N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide

C15H16N2OS — CID 17438306

IUPACN-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
SMILESCc1cccc(-c2nc(CC(=O)NC3CC3)cs2)c1
InChIInChI=1S/C15H16N2OS/c1-10-3-2-4-11(7-10)15-17-13(9-19-15)8-14(18)16-12-5-6-12/h2-4,7,9,12H,5-6,8H2,1H3,(H,16,18)
InChIKeyWIHXQMNDDNUZEC-UHFFFAOYSA-N
MW272.37 g/mol
LogP2.94
Rot. Bonds4

About N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide

N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide (PubChem CID 17438306) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
PubChem CID17438306
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
SMILESCc1cccc(-c2nc(CC(=O)NC3CC3)cs2)c1
InChIInChI=1S/C15H16N2OS/c1-10-3-2-4-11(7-10)15-17-13(9-19-15)8-14(18)16-12-5-6-12/h2-4,7,9,12H,5-6,8H2,1H3,(H,16,18)
InChIKeyWIHXQMNDDNUZEC-UHFFFAOYSA-N
XLogP2.94
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-[(1R,3R)-3-(trifluoromethyl)cyclohexyl]acetamide
CID 35223807
2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-N-(4-methylcyclohexyl)acetamide
CID 55363994
N-(4-ethylcyclohexyl)-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 112816461
N-cyclopentyl-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 26722000
N-cyclopropyl-1-[2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetyl]pyrrolidine-2-carboxamide
CID 78857638
N-(4-aminocyclohexyl)-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 119474502
2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(2-methylpiperidin-3-yl)acetamide;dihydrochloride
CID 120574533
N-cyclohexyl-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 17435272
N-[2-(tert-butylamino)-2-oxoethyl]-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 41276962
2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 29370077
N-[2-(ethylamino)ethyl]-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 119509228
N-cyclopropyl-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 17392861

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide (CID 17438306) is N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide is Cc1cccc(-c2nc(CC(=O)NC3CC3)cs2)c1.
What is the InChIKey of N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide?
The InChIKey is WIHXQMNDDNUZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-10-3-2-4-11(7-10)15-17-13(9-19-15)8-14(18)16-12-5-6-12/h2-4,7,9,12H,5-6,8H2,1H3,(H,16,18).
What are the key properties of N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide?
N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 272.37 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 17438306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).