1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide

C19H24FN3O4 — CID 51276378

IUPAC1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide
SMILESCC(Oc1ccc(F)cc1)C(=O)NNC(=O)C1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C19H24FN3O4/c1-12(27-16-8-6-14(20)7-9-16)18(25)21-22-19(26)13-10-17(24)23(11-13)15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,21,25)(H,22,26)
InChIKeyXEKRUEOTKLSGFL-UHFFFAOYSA-N
MW377.42 g/mol
LogP1.53
Rot. Bonds5

About 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide

1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide (PubChem CID 51276378) has the molecular formula C19H24FN3O4 and a molecular weight of 377.42 g/mol. Its IUPAC name is 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide.

Molecular Properties

Compound Name1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide
PubChem CID51276378
Molecular FormulaC19H24FN3O4
Molecular Weight377.42 g/mol
Exact Mass377.18
IUPAC Name1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide
SMILESCC(Oc1ccc(F)cc1)C(=O)NNC(=O)C1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C19H24FN3O4/c1-12(27-16-8-6-14(20)7-9-16)18(25)21-22-19(26)13-10-17(24)23(11-13)15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,21,25)(H,22,26)
InChIKeyXEKRUEOTKLSGFL-UHFFFAOYSA-N
XLogP1.53
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[2-(4-fluorophenoxy)propanoyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carbohydrazide
CID 55559454
1-(2-fluoro-4-methylphenyl)-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide
CID 46407999
1-(2,4-difluorophenyl)-N'-(2-naphthalen-2-yloxypropanoyl)-5-oxopyrrolidine-3-carbohydrazide
CID 55616525
[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] (3S)-1-cyclopentyl-5-oxopyrrolidine-3-carboxylate
CID 8953350
1-cyclohexyl-N-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 4246129
1-cyclopentyl-N-[2-(4-fluorophenyl)-2-hydroxyethyl]-5-oxopyrrolidine-3-carboxamide
CID 78866844
1-cyclopentyl-5-oxo-N-[2-(propan-2-ylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 17081472
[(2R)-1-(2-benzoylhydrazinyl)-1-oxopropan-2-yl] (3R)-1-cyclopentyl-5-oxopyrrolidine-3-carboxylate
CID 9060830
(3S)-1-cyclopentyl-N-(5-fluoro-2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 8572944
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide
CID 51165989
(2R)-N'-(3-cyclopentylpropanoyl)-2-(4-fluorophenoxy)propanehydrazide
CID 7965228

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide?
The IUPAC name of 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide (CID 51276378) is 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide.
What is the SMILES notation for 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide?
The canonical SMILES for 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide is CC(Oc1ccc(F)cc1)C(=O)NNC(=O)C1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide?
The InChIKey is XEKRUEOTKLSGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O4/c1-12(27-16-8-6-14(20)7-9-16)18(25)21-22-19(26)13-10-17(24)23(11-13)15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,21,25)(H,22,26).
What are the key properties of 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide?
1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide has a molecular weight of 377.42 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N'-[2-(4-fluorophenoxy)propanoyl]-5-oxopyrrolidine-3-carbohydrazide is sourced from PubChem (CID 51276378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).