N'-(3-fluorophenyl)cyclobutanecarbohydrazide

C11H13FN2O — CID 169221984

IUPACN'-(3-fluorophenyl)cyclobutanecarbohydrazide
SMILESO=C(NNc1cccc(F)c1)C1CCC1
InChIInChI=1S/C11H13FN2O/c12-9-5-2-6-10(7-9)13-14-11(15)8-3-1-4-8/h2,5-8,13H,1,3-4H2,(H,14,15)
InChIKeyFUZYRNBUOQSGIQ-UHFFFAOYSA-N
MW208.24 g/mol
LogP2.07
Rot. Bonds3

About N'-(3-fluorophenyl)cyclobutanecarbohydrazide

N'-(3-fluorophenyl)cyclobutanecarbohydrazide (PubChem CID 169221984) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is N'-(3-fluorophenyl)cyclobutanecarbohydrazide.

Molecular Properties

Compound NameN'-(3-fluorophenyl)cyclobutanecarbohydrazide
PubChem CID169221984
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC NameN'-(3-fluorophenyl)cyclobutanecarbohydrazide
SMILESO=C(NNc1cccc(F)c1)C1CCC1
InChIInChI=1S/C11H13FN2O/c12-9-5-2-6-10(7-9)13-14-11(15)8-3-1-4-8/h2,5-8,13H,1,3-4H2,(H,14,15)
InChIKeyFUZYRNBUOQSGIQ-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-bromophenyl)cyclobutanecarbohydrazide
CID 67269294
trans-(1S,3S)-1-N,3-N-bis(3-fluorophenyl)cyclohexane-1,3-dicarboxamide
CID 7832111
N-[2-(3-fluoroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 772134
N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide
CID 772128
(3S)-1-acetyl-N-(3-fluorophenyl)piperidine-3-carboxamide
CID 9068167
3-[4-[(3-fluorophenyl)carbamoyl]piperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120549857
(3S)-N-(3-fluorophenyl)-1-methylsulfonylpiperidine-3-carboxamide
CID 7258343
1-N-(4-acetamidophenyl)-4-N-(3-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109151103
1-(cyclopropanecarbonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 26086523
(3-fluoroanilino)thiourea
CID 1482872
(3R)-N-(3-fluorophenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 51686412
4-N-(3-fluorophenyl)-1-N-propan-2-ylpiperidine-1,4-dicarboxamide
CID 113008251

Frequently Asked Questions

What is the IUPAC name of N'-(3-fluorophenyl)cyclobutanecarbohydrazide?
The IUPAC name of N'-(3-fluorophenyl)cyclobutanecarbohydrazide (CID 169221984) is N'-(3-fluorophenyl)cyclobutanecarbohydrazide.
What is the SMILES notation for N'-(3-fluorophenyl)cyclobutanecarbohydrazide?
The canonical SMILES for N'-(3-fluorophenyl)cyclobutanecarbohydrazide is O=C(NNc1cccc(F)c1)C1CCC1.
What is the InChIKey of N'-(3-fluorophenyl)cyclobutanecarbohydrazide?
The InChIKey is FUZYRNBUOQSGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c12-9-5-2-6-10(7-9)13-14-11(15)8-3-1-4-8/h2,5-8,13H,1,3-4H2,(H,14,15).
What are the key properties of N'-(3-fluorophenyl)cyclobutanecarbohydrazide?
N'-(3-fluorophenyl)cyclobutanecarbohydrazide has a molecular weight of 208.24 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-fluorophenyl)cyclobutanecarbohydrazide is sourced from PubChem (CID 169221984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).