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

C14H15Cl2N3O2S — CID 91608788

IUPACN-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide
SMILESCCCNc1nc(O)c(CC(=O)Nc2cccc(Cl)c2Cl)s1
InChIInChI=1S/C14H15Cl2N3O2S/c1-2-6-17-14-19-13(21)10(22-14)7-11(20)18-9-5-3-4-8(15)12(9)16/h3-5,21H,2,6-7H2,1H3,(H,17,19)(H,18,20)
InChIKeyVMGAIMNJEJBIQU-UHFFFAOYSA-N
MW360.27 g/mol
LogP4.16
Rot. Bonds6

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

N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide (PubChem CID 91608788) has the molecular formula C14H15Cl2N3O2S and a molecular weight of 360.27 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide
PubChem CID91608788
Molecular FormulaC14H15Cl2N3O2S
Molecular Weight360.27 g/mol
Exact Mass359.03
IUPAC NameN-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide
SMILESCCCNc1nc(O)c(CC(=O)Nc2cccc(Cl)c2Cl)s1
InChIInChI=1S/C14H15Cl2N3O2S/c1-2-6-17-14-19-13(21)10(22-14)7-11(20)18-9-5-3-4-8(15)12(9)16/h3-5,21H,2,6-7H2,1H3,(H,17,19)(H,18,20)
InChIKeyVMGAIMNJEJBIQU-UHFFFAOYSA-N
XLogP4.16
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.27
LogP ≤ 54.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-anilino-4-hydroxy-1,3-thiazol-5-yl)-N-(2-chlorophenyl)acetamide
CID 91431214
N-(2,3-dichlorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide
CID 110679766
1-(2,3-dichlorophenyl)-3-propylurea
CID 4654956
N-(2,3-dichlorophenyl)-2-(3,4-dihydroxyphenyl)acetamide
CID 113199172
N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenyl)acetamide
CID 41362554
N-(2,3-dichlorophenyl)-2-(hexadecylamino)acetamide
CID 54808960
6-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,6-diamine
CID 80754904
2-(4-bromophenyl)-N-(2,3-dichlorophenyl)acetamide
CID 1346170
1-(2,3-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991483
N-(2,3-dichlorophenyl)-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112524517
N,N'-bis(2,3-dichlorophenyl)dodecanediamide
CID 3641487
N-(2,3-dichlorophenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 2100218

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide (CID 91608788) is N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide is CCCNc1nc(O)c(CC(=O)Nc2cccc(Cl)c2Cl)s1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide?
The InChIKey is VMGAIMNJEJBIQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3O2S/c1-2-6-17-14-19-13(21)10(22-14)7-11(20)18-9-5-3-4-8(15)12(9)16/h3-5,21H,2,6-7H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide?
N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide has a molecular weight of 360.27 g/mol, XLogP of 4.16, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[4-hydroxy-2-(propylamino)-1,3-thiazol-5-yl]acetamide is sourced from PubChem (CID 91608788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).