N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide

C16H16FN3O — CID 74713535

IUPACN-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CC(c2ccccc2)NN1
InChIInChI=1S/C16H16FN3O/c17-12-7-4-8-13(9-12)18-16(21)15-10-14(19-20-15)11-5-2-1-3-6-11/h1-9,14-15,19-20H,10H2,(H,18,21)
InChIKeyCRNGSELFRKZNJY-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.37
Rot. Bonds3

About N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide

N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide (PubChem CID 74713535) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide
PubChem CID74713535
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC NameN-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CC(c2ccccc2)NN1
InChIInChI=1S/C16H16FN3O/c17-12-7-4-8-13(9-12)18-16(21)15-10-14(19-20-15)11-5-2-1-3-6-11/h1-9,14-15,19-20H,10H2,(H,18,21)
InChIKeyCRNGSELFRKZNJY-UHFFFAOYSA-N
XLogP2.37
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-5-phenylpyrazolidine-3-carboxamide
CID 84865436
N,5-bis(3-chlorophenyl)pyrazolidine-3-carboxamide
CID 75254883
5-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
CID 75254901
N-(3-cyanophenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975429
N-(5,6-difluoro-1H-indol-3-yl)-5-phenylpyrazolidine-3-carboxamide
CID 168678351
N-(3-acetylphenyl)-5-(4-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75234345
N-[3-[[(5-phenylpyrazolidine-3-carbonyl)amino]carbamoyl]phenyl]thiophene-2-carboxamide
CID 74537412
N-(2,5-dichlorophenyl)-5-phenylpyrazolidine-3-carboxamide
CID 122363085
5-(3-chlorophenyl)-N-(5-fluoro-2-methylphenyl)pyrazolidine-3-carboxamide
CID 74623810
N-ethyl-5-phenylpyrazolidine-3-carboxamide
CID 73487890
N-(3-fluorophenyl)piperazine-2-carboxamide
CID 63103446
N-(3,5-dimethylphenyl)-5-(4-methylphenyl)pyrazolidine-3-carboxamide
CID 75605659

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide (CID 74713535) is N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide is O=C(Nc1cccc(F)c1)C1CC(c2ccccc2)NN1.
What is the InChIKey of N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide?
The InChIKey is CRNGSELFRKZNJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c17-12-7-4-8-13(9-12)18-16(21)15-10-14(19-20-15)11-5-2-1-3-6-11/h1-9,14-15,19-20H,10H2,(H,18,21).
What are the key properties of N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide?
N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide has a molecular weight of 285.32 g/mol, XLogP of 2.37, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide is sourced from PubChem (CID 74713535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).