N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide

C11H12FNO2 — CID 64781438

IUPACN-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide
SMILESO=C(Nc1ccc(O)c(F)c1)C1CCC1
InChIInChI=1S/C11H12FNO2/c12-9-6-8(4-5-10(9)14)13-11(15)7-2-1-3-7/h4-7,14H,1-3H2,(H,13,15)
InChIKeyDXDLROHMQWTLBV-UHFFFAOYSA-N
MW209.22 g/mol
LogP2.27
Rot. Bonds2

About N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide

N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide (PubChem CID 64781438) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide
PubChem CID64781438
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC NameN-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide
SMILESO=C(Nc1ccc(O)c(F)c1)C1CCC1
InChIInChI=1S/C11H12FNO2/c12-9-6-8(4-5-10(9)14)13-11(15)7-2-1-3-7/h4-7,14H,1-3H2,(H,13,15)
InChIKeyDXDLROHMQWTLBV-UHFFFAOYSA-N
XLogP2.27
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(3-fluoro-4-hydroxyphenyl)cyclopropanecarboxamide
CID 64780100
N-(3-fluoro-4-hydroxyphenyl)oxane-3-carboxamide
CID 64780687
N-(3-fluoro-4-hydroxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106893109
N-(3-chloro-4-fluorophenyl)cyclopentanecarboxamide
CID 845055
N-(3-fluoro-4-hydroxyphenyl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102893200
N-(4-bromo-3-fluorophenyl)cyclopropanecarboxamide
CID 65436838
N-(4-chloro-3-fluorophenyl)cyclopropanecarboxamide
CID 60776243
N-(3-fluoro-4-pyrrolidin-1-ylphenyl)cyclopropanecarboxamide
CID 47311897
N-(5-acetamido-2-fluorophenyl)cyclobutanecarboxamide
CID 46429163
1-cyclohexyl-3-(3-fluoro-4-hydroxyphenyl)urea
CID 64780517
N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclohexanecarboxamide
CID 30148120
N-(3-fluoro-4-hydroxyphenyl)acetamide
CID 3014069

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide?
The IUPAC name of N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide (CID 64781438) is N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide?
The canonical SMILES for N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide is O=C(Nc1ccc(O)c(F)c1)C1CCC1.
What is the InChIKey of N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide?
The InChIKey is DXDLROHMQWTLBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c12-9-6-8(4-5-10(9)14)13-11(15)7-2-1-3-7/h4-7,14H,1-3H2,(H,13,15).
What are the key properties of N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide?
N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide has a molecular weight of 209.22 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide is sourced from PubChem (CID 64781438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).