N-(4-fluorophenyl)pyrazolidine-3-carboxamide

C10H12FN3O — CID 75220517

IUPACN-(4-fluorophenyl)pyrazolidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCNN1
InChIInChI=1S/C10H12FN3O/c11-7-1-3-8(4-2-7)13-10(15)9-5-6-12-14-9/h1-4,9,12,14H,5-6H2,(H,13,15)
InChIKeyYBRKYXWJFXOHJL-UHFFFAOYSA-N
MW209.22 g/mol
LogP0.63
Rot. Bonds2

About N-(4-fluorophenyl)pyrazolidine-3-carboxamide

N-(4-fluorophenyl)pyrazolidine-3-carboxamide (PubChem CID 75220517) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is N-(4-fluorophenyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)pyrazolidine-3-carboxamide
PubChem CID75220517
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC NameN-(4-fluorophenyl)pyrazolidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCNN1
InChIInChI=1S/C10H12FN3O/c11-7-1-3-8(4-2-7)13-10(15)9-5-6-12-14-9/h1-4,9,12,14H,5-6H2,(H,13,15)
InChIKeyYBRKYXWJFXOHJL-UHFFFAOYSA-N
XLogP0.63
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The IUPAC name of N-(4-fluorophenyl)pyrazolidine-3-carboxamide (CID 75220517) is N-(4-fluorophenyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)pyrazolidine-3-carboxamide is O=C(Nc1ccc(F)cc1)C1CCNN1.
What is the InChIKey of N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The InChIKey is YBRKYXWJFXOHJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c11-7-1-3-8(4-2-7)13-10(15)9-5-6-12-14-9/h1-4,9,12,14H,5-6H2,(H,13,15).
What are the key properties of N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
N-(4-fluorophenyl)pyrazolidine-3-carboxamide has a molecular weight of 209.22 g/mol, XLogP of 0.63, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 75220517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).