5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide

C17H15ClF3N3O — CID 75254901

IUPAC5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
SMILESO=C(Nc1cccc(C(F)(F)F)c1)C1CC(c2cccc(Cl)c2)NN1
InChIInChI=1S/C17H15ClF3N3O/c18-12-5-1-3-10(7-12)14-9-15(24-23-14)16(25)22-13-6-2-4-11(8-13)17(19,20)21/h1-8,14-15,23-24H,9H2,(H,22,25)
InChIKeyIVUSSVDFSMOUBZ-UHFFFAOYSA-N
MW369.77 g/mol
LogP3.91
Rot. Bonds3

About 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide

5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide (PubChem CID 75254901) has the molecular formula C17H15ClF3N3O and a molecular weight of 369.77 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
PubChem CID75254901
Molecular FormulaC17H15ClF3N3O
Molecular Weight369.77 g/mol
Exact Mass369.09
IUPAC Name5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
SMILESO=C(Nc1cccc(C(F)(F)F)c1)C1CC(c2cccc(Cl)c2)NN1
InChIInChI=1S/C17H15ClF3N3O/c18-12-5-1-3-10(7-12)14-9-15(24-23-14)16(25)22-13-6-2-4-11(8-13)17(19,20)21/h1-8,14-15,23-24H,9H2,(H,22,25)
InChIKeyIVUSSVDFSMOUBZ-UHFFFAOYSA-N
XLogP3.91
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.77
LogP ≤ 53.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,5-bis(3-chlorophenyl)pyrazolidine-3-carboxamide
CID 75254883
5-(3-chlorophenyl)-N-(3-methylphenyl)pyrazolidine-3-carboxamide
CID 74623711
N-(3-carbamoylphenyl)-5-(3-chlorophenyl)pyrazolidine-3-carboxamide
CID 75254869
5-(3-chlorophenyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
CID 75254921
dimethyl 5-[[5-(3-chlorophenyl)pyrazolidine-3-carbonyl]amino]benzene-1,3-dicarboxylate
CID 75254878
5-(3-chlorophenyl)-N-(3-fluoro-2-methylphenyl)pyrazolidine-3-carboxamide
CID 75254935
5-(3-chlorophenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazolidine-3-carboxamide
CID 52989249
N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide
CID 74713535
5-(3-chlorophenyl)-N-(5-fluoro-2-methylphenyl)pyrazolidine-3-carboxamide
CID 74623810
N-(2-benzoylphenyl)-5-(3-chlorophenyl)pyrazolidine-3-carboxamide
CID 75254865
N-(3-acetylphenyl)-5-phenylpyrazolidine-3-carboxamide
CID 84865436
1-N,4-N-bis[3-(trifluoromethyl)phenyl]cyclohexane-1,4-dicarboxamide
CID 17197875

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide?
The IUPAC name of 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide (CID 75254901) is 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide?
The canonical SMILES for 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide is O=C(Nc1cccc(C(F)(F)F)c1)C1CC(c2cccc(Cl)c2)NN1.
What is the InChIKey of 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide?
The InChIKey is IVUSSVDFSMOUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClF3N3O/c18-12-5-1-3-10(7-12)14-9-15(24-23-14)16(25)22-13-6-2-4-11(8-13)17(19,20)21/h1-8,14-15,23-24H,9H2,(H,22,25).
What are the key properties of 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide?
5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide has a molecular weight of 369.77 g/mol, XLogP of 3.91, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide is sourced from PubChem (CID 75254901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).