2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide

C21H24N2O2S — CID 118785670

IUPAC2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCC(C)c1nc(CCNC(=O)CC2=C(c3ccccc3)CCC2=O)cs1
InChIInChI=1S/C21H24N2O2S/c1-14(2)21-23-16(13-26-21)10-11-22-20(25)12-18-17(8-9-19(18)24)15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3,(H,22,25)
InChIKeyGOGCMXXEYNWBEV-UHFFFAOYSA-N
MW368.50 g/mol
LogP4.13
Rot. Bonds7

About 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide

2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide (PubChem CID 118785670) has the molecular formula C21H24N2O2S and a molecular weight of 368.50 g/mol. Its IUPAC name is 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide
PubChem CID118785670
Molecular FormulaC21H24N2O2S
Molecular Weight368.50 g/mol
Exact Mass368.16
IUPAC Name2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCC(C)c1nc(CCNC(=O)CC2=C(c3ccccc3)CCC2=O)cs1
InChIInChI=1S/C21H24N2O2S/c1-14(2)21-23-16(13-26-21)10-11-22-20(25)12-18-17(8-9-19(18)24)15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3,(H,22,25)
InChIKeyGOGCMXXEYNWBEV-UHFFFAOYSA-N
XLogP4.13
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide;dihydrochloride
CID 119869470
2-amino-2-phenyl-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide;dihydrochloride
CID 119869430
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 38162050
cis-(1R,2S)-2-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 125132098
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-(2-phenylethyl)acetamide
CID 82547633
(2R)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]piperidine-2-carboxamide;dihydrochloride
CID 119869426
2-(4-chlorophenyl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 35343942
N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]-3-(1,2-thiazol-5-yl)benzamide
CID 169411645
5-acetyl-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]thiophene-3-carboxamide
CID 118770282
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 35343656
N-ethyl-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 91286036
N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide
CID 35344893

Frequently Asked Questions

What is the IUPAC name of 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide (CID 118785670) is 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide is CC(C)c1nc(CCNC(=O)CC2=C(c3ccccc3)CCC2=O)cs1.
What is the InChIKey of 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The InChIKey is GOGCMXXEYNWBEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2S/c1-14(2)21-23-16(13-26-21)10-11-22-20(25)12-18-17(8-9-19(18)24)15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3,(H,22,25).
What are the key properties of 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide?
2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide has a molecular weight of 368.50 g/mol, XLogP of 4.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-oxo-2-phenylcyclopenten-1-yl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 118785670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).