N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide

C17H18FN3O2 — CID 75234366

IUPACN-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide
SMILESCOc1cccc(C2CC(C(=O)Nc3ccccc3F)NN2)c1
InChIInChI=1S/C17H18FN3O2/c1-23-12-6-4-5-11(9-12)15-10-16(21-20-15)17(22)19-14-8-3-2-7-13(14)18/h2-9,15-16,20-21H,10H2,1H3,(H,19,22)
InChIKeyGKGPHCJUYHDTBR-UHFFFAOYSA-N
MW315.35 g/mol
LogP2.38
Rot. Bonds4

About N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide

N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide (PubChem CID 75234366) has the molecular formula C17H18FN3O2 and a molecular weight of 315.35 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide
PubChem CID75234366
Molecular FormulaC17H18FN3O2
Molecular Weight315.35 g/mol
Exact Mass315.14
IUPAC NameN-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide
SMILESCOc1cccc(C2CC(C(=O)Nc3ccccc3F)NN2)c1
InChIInChI=1S/C17H18FN3O2/c1-23-12-6-4-5-11(9-12)15-10-16(21-20-15)17(22)19-14-8-3-2-7-13(14)18/h2-9,15-16,20-21H,10H2,1H3,(H,19,22)
InChIKeyGKGPHCJUYHDTBR-UHFFFAOYSA-N
XLogP2.38
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-methoxyphenyl)pyrazolidine-3-carbohydrazide
CID 78349199
N-(2,4-dimethoxyphenyl)-5-phenylpyrazolidine-3-carboxamide
CID 74523011
N-[4-(diethylamino)-2-methylphenyl]-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75254957
5-(3-chlorophenyl)-N-(3-fluoro-2-methylphenyl)pyrazolidine-3-carboxamide
CID 75254935
N-(2,5-difluorophenyl)-5-(2,4-dimethoxyphenyl)pyrazolidine-3-carboxamide
CID 75255014
N-[(2-chloro-4-fluorophenyl)methyl]-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75255262
5-(2,4-dimethoxyphenyl)-N-(2-methylphenyl)pyrazolidine-3-carboxamide
CID 75254961
5-(4-fluorophenyl)-N-(6-methoxyquinolin-8-yl)pyrazolidine-3-carboxamide
CID 75355090
5-(3-methoxyphenyl)-N-[4-[(2R)-morpholin-2-yl]phenyl]pyrazolidine-3-carboxamide
CID 118704712
5-(3-chlorophenyl)-N-(5-fluoro-2-methylphenyl)pyrazolidine-3-carboxamide
CID 74623810
5-(4-ethoxyphenyl)-N-(2-methoxyphenyl)pyrazolidine-3-carboxamide
CID 75234255
N-(3-fluorophenyl)-5-phenylpyrazolidine-3-carboxamide
CID 74713535

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide (CID 75234366) is N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide is COc1cccc(C2CC(C(=O)Nc3ccccc3F)NN2)c1.
What is the InChIKey of N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide?
The InChIKey is GKGPHCJUYHDTBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O2/c1-23-12-6-4-5-11(9-12)15-10-16(21-20-15)17(22)19-14-8-3-2-7-13(14)18/h2-9,15-16,20-21H,10H2,1H3,(H,19,22).
What are the key properties of N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide?
N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide has a molecular weight of 315.35 g/mol, XLogP of 2.38, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 75234366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).