2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol

C11H13BrFNO — CID 107635614

IUPAC2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol
SMILESOC1CCCC1Nc1cc(F)ccc1Br
InChIInChI=1S/C11H13BrFNO/c12-8-5-4-7(13)6-10(8)14-9-2-1-3-11(9)15/h4-6,9,11,14-15H,1-3H2
InChIKeyVQIOASVQLORLBT-UHFFFAOYSA-N
MW274.13 g/mol
LogP2.91
Rot. Bonds2

About 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol

2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol (PubChem CID 107635614) has the molecular formula C11H13BrFNO and a molecular weight of 274.13 g/mol. Its IUPAC name is 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol
PubChem CID107635614
Molecular FormulaC11H13BrFNO
Molecular Weight274.13 g/mol
Exact Mass273.02
IUPAC Name2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol
SMILESOC1CCCC1Nc1cc(F)ccc1Br
InChIInChI=1S/C11H13BrFNO/c12-8-5-4-7(13)6-10(8)14-9-2-1-3-11(9)15/h4-6,9,11,14-15H,1-3H2
InChIKeyVQIOASVQLORLBT-UHFFFAOYSA-N
XLogP2.91
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.13
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-5-fluoro-N-(2-methylcyclopentyl)aniline
CID 107632740
trans-(1S,2S)-2-(2-bromo-5-chloroanilino)cyclopentan-1-ol
CID 102733775
2-bromo-N-cyclobutyl-5-fluoroaniline
CID 107633201
trans-(1S,2S)-2-(2-chloro-5-fluoroanilino)cyclohexan-1-ol
CID 107528235
trans-(1R,2R)-2-(5-fluoro-2-methylanilino)cyclohexan-1-ol
CID 102730941
2-bromo-N-(2-cyclohexylcyclohexyl)-5-fluoroaniline
CID 107632713
trans-(1S,2S)-2-(5-bromo-2,4-difluoroanilino)cyclopentan-1-ol
CID 102853369
2-(2,3,5-trifluoroanilino)cyclohexan-1-ol
CID 55118688
trans-(1R,2R)-2-(3-fluoroanilino)cyclopentan-1-ol
CID 93345851
2-bromo-4-fluoro-N-(2-methylcyclopentyl)aniline
CID 65046775
2-(4-bromo-2-fluoroanilino)cycloheptan-1-ol
CID 60898844
2-(2,4-difluoroanilino)cyclobutan-1-ol
CID 126856726

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol?
The IUPAC name of 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol (CID 107635614) is 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol.
What is the SMILES notation for 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol?
The canonical SMILES for 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol is OC1CCCC1Nc1cc(F)ccc1Br.
What is the InChIKey of 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol?
The InChIKey is VQIOASVQLORLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrFNO/c12-8-5-4-7(13)6-10(8)14-9-2-1-3-11(9)15/h4-6,9,11,14-15H,1-3H2.
What are the key properties of 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol?
2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol has a molecular weight of 274.13 g/mol, XLogP of 2.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-fluoroanilino)cyclopentan-1-ol is sourced from PubChem (CID 107635614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).