N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide

C13H11Cl2F3N4O — CID 75430742

IUPACN-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide
SMILESO=C(CNc1ccn(CC(F)(F)F)n1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C13H11Cl2F3N4O/c14-8-2-1-3-9(12(8)15)20-11(23)6-19-10-4-5-22(21-10)7-13(16,17)18/h1-5H,6-7H2,(H,19,21)(H,20,23)
InChIKeyWUCQOZANLFHJFM-UHFFFAOYSA-N
MW367.16 g/mol
LogP3.80
Rot. Bonds5

About N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide

N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide (PubChem CID 75430742) has the molecular formula C13H11Cl2F3N4O and a molecular weight of 367.16 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide
PubChem CID75430742
Molecular FormulaC13H11Cl2F3N4O
Molecular Weight367.16 g/mol
Exact Mass366.03
IUPAC NameN-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide
SMILESO=C(CNc1ccn(CC(F)(F)F)n1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C13H11Cl2F3N4O/c14-8-2-1-3-9(12(8)15)20-11(23)6-19-10-4-5-22(21-10)7-13(16,17)18/h1-5H,6-7H2,(H,19,21)(H,20,23)
InChIKeyWUCQOZANLFHJFM-UHFFFAOYSA-N
XLogP3.80
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.16
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(3,4-dichlorophenyl)pyrazol-3-yl]-2-piperidin-1-ylacetamide
CID 24743571
1-(2,3-Dichlorophenyl)-3-(2-methylpyrazol-3-yl)urea
CID 2808879
2-cyano-N-[1-(3,4-dichlorophenyl)pyrazol-3-yl]acetamide
CID 155568071
2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2,3-dichlorophenyl)acetamide
CID 1113733
2-[[1-(2-amino-2-oxoethyl)pyrazol-3-yl]amino]-N-(2-chloro-4-methylphenyl)acetamide
CID 47068722
1-(3,4-dichlorophenyl)-3-(2-(3-(trifluoromethyl)-1H-pyrazol-1-yl)ethyl)urea
CID 71808085
N-(3,4-dichlorophenyl)-2-(1H-pyrazol-1-yl)acetamide
CID 15943479
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 4784898
N-(3-Chloro-4-fluorophenyl)-N'-(1-methyl-1H-pyrazol-3-YL)urea
CID 970878
N-(1-methylpyrazol-3-yl)-N'-(3,4,5-trifluorophenyl)oxamide
CID 99801685
N-(3,4-dichlorophenyl)-2-(7-oxopyrazolo[1,5-a]pyrimidin-4-yl)acetamide
CID 121567620
N-[1-(3-chlorophenyl)pyrazol-3-yl]-2,2,2-trifluoroacetamide
CID 57308674

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide (CID 75430742) is N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide is O=C(CNc1ccn(CC(F)(F)F)n1)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide?
The InChIKey is WUCQOZANLFHJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2F3N4O/c14-8-2-1-3-9(12(8)15)20-11(23)6-19-10-4-5-22(21-10)7-13(16,17)18/h1-5H,6-7H2,(H,19,21)(H,20,23).
What are the key properties of N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide?
N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide has a molecular weight of 367.16 g/mol, XLogP of 3.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]acetamide is sourced from PubChem (CID 75430742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).