N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide

C14H17FN2O3 — CID 18158775

IUPACN'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)C1CCC1
InChIInChI=1S/C14H17FN2O3/c1-9(20-12-8-3-2-7-11(12)15)13(18)16-17-14(19)10-5-4-6-10/h2-3,7-10H,4-6H2,1H3,(H,16,18)(H,17,19)
InChIKeyFKYZZZXMHJJXQO-UHFFFAOYSA-N
MW280.30 g/mol
LogP1.54
Rot. Bonds4

About N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide

N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide (PubChem CID 18158775) has the molecular formula C14H17FN2O3 and a molecular weight of 280.30 g/mol. Its IUPAC name is N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide
PubChem CID18158775
Molecular FormulaC14H17FN2O3
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC NameN'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)C1CCC1
InChIInChI=1S/C14H17FN2O3/c1-9(20-12-8-3-2-7-11(12)15)13(18)16-17-14(19)10-5-4-6-10/h2-3,7-10H,4-6H2,1H3,(H,16,18)(H,17,19)
InChIKeyFKYZZZXMHJJXQO-UHFFFAOYSA-N
XLogP1.54
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(benzenesulfonyl)-N'-[2-(2-fluorophenoxy)propanoyl]piperidine-2-carbohydrazide
CID 55342269
N'-[2-(2-fluorophenoxy)propanoyl]-1-(naphthalene-1-carbonyl)piperidine-3-carbohydrazide
CID 46653800
1-[[(2S)-2-(2-fluorophenoxy)propanoyl]amino]-3-methylthiourea
CID 8767721
1-[[(2R)-2-(2-fluorophenoxy)propanoyl]amino]-3-[(1S,2R)-2-methylcyclohexyl]thiourea
CID 8767842
(3S)-N'-[(2R)-2-(2-fluorophenoxy)propanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
CID 7761030
2-(2-fluorophenoxy)-N'-[2-(2-fluorophenoxy)acetyl]propanehydrazide
CID 51156370
2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
CID 47102861
cis-(1R,3S)-3-[2-(2-fluorophenoxy)propanoylamino]cyclopentane-1-carboxylic acid
CID 106320893
N'-(2-cyclopent-2-en-1-ylacetyl)-2-(2-fluorophenoxy)propanehydrazide
CID 46653754
[(2S)-1-[2-[(2S)-2-(2-fluorophenoxy)propanoyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]urea
CID 9372574
N'-[(2S)-2-(2-fluorophenoxy)propanoyl]naphthalene-2-carbohydrazide
CID 7760964
N'-[2-(2,5-dimethylphenoxy)propanoyl]cyclohexanecarbohydrazide
CID 4945045

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide?
The IUPAC name of N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide (CID 18158775) is N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide.
What is the SMILES notation for N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide?
The canonical SMILES for N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide is CC(Oc1ccccc1F)C(=O)NNC(=O)C1CCC1.
What is the InChIKey of N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide?
The InChIKey is FKYZZZXMHJJXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O3/c1-9(20-12-8-3-2-7-11(12)15)13(18)16-17-14(19)10-5-4-6-10/h2-3,7-10H,4-6H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide?
N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide has a molecular weight of 280.30 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide is sourced from PubChem (CID 18158775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).