2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide

C17H18Cl2N4O2S — CID 41211744

IUPAC2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide
SMILESO=C(Cc1csc(NC(=O)NC2CCCC2)n1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H18Cl2N4O2S/c18-10-5-11(19)7-13(6-10)20-15(24)8-14-9-26-17(22-14)23-16(25)21-12-3-1-2-4-12/h5-7,9,12H,1-4,8H2,(H,20,24)(H2,21,22,23,25)
InChIKeyLONAWLYTAQHPOE-UHFFFAOYSA-N
MW413.33 g/mol
LogP4.70
Rot. Bonds5

About 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide

2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide (PubChem CID 41211744) has the molecular formula C17H18Cl2N4O2S and a molecular weight of 413.33 g/mol. Its IUPAC name is 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide
PubChem CID41211744
Molecular FormulaC17H18Cl2N4O2S
Molecular Weight413.33 g/mol
Exact Mass412.05
IUPAC Name2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide
SMILESO=C(Cc1csc(NC(=O)NC2CCCC2)n1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H18Cl2N4O2S/c18-10-5-11(19)7-13(6-10)20-15(24)8-14-9-26-17(22-14)23-16(25)21-12-3-1-2-4-12/h5-7,9,12H,1-4,8H2,(H,20,24)(H2,21,22,23,25)
InChIKeyLONAWLYTAQHPOE-UHFFFAOYSA-N
XLogP4.70
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.33
LogP ≤ 54.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(4-methylphenyl)acetamide
CID 27505510
2-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,4-dimethylphenyl)acetamide
CID 43996976
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(2,4,6-trimethylphenyl)acetamide
CID 27463137
N-(5-chloro-2-methoxyphenyl)-2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]acetamide
CID 27444463
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(4-ethoxyphenyl)acetamide
CID 27652941
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(4-phenoxyphenyl)acetamide
CID 41211729
2-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(cyclohexylmethyl)acetamide
CID 20930030
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(2,3-dimethylphenyl)acetamide
CID 27542821
2-[2-(3-chloroanilino)-1,3-thiazol-4-yl]-N-cyclohexylacetamide
CID 27377986
2-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(2,3-dimethylphenyl)acetamide
CID 43996974
1-cyclohexyl-3-[4-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-yl]urea
CID 41211603
1-[4-[2-(azepan-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]-3-cyclopentylurea
CID 41211659

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide?
The IUPAC name of 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide (CID 41211744) is 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide is O=C(Cc1csc(NC(=O)NC2CCCC2)n1)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide?
The InChIKey is LONAWLYTAQHPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N4O2S/c18-10-5-11(19)7-13(6-10)20-15(24)8-14-9-26-17(22-14)23-16(25)21-12-3-1-2-4-12/h5-7,9,12H,1-4,8H2,(H,20,24)(H2,21,22,23,25).
What are the key properties of 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide?
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide has a molecular weight of 413.33 g/mol, XLogP of 4.70, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(3,5-dichlorophenyl)acetamide is sourced from PubChem (CID 41211744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).