5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol

C12H16FNO — CID 84780716

IUPAC5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol
SMILESCc1cc(F)c(O)cc1C1(N)CCCC1
InChIInChI=1S/C12H16FNO/c1-8-6-10(13)11(15)7-9(8)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3
InChIKeyQAUZTXVUTOOKTE-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.57
Rot. Bonds1

About 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol

5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol (PubChem CID 84780716) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol.

Molecular Properties

Compound Name5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol
PubChem CID84780716
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol
SMILESCc1cc(F)c(O)cc1C1(N)CCCC1
InChIInChI=1S/C12H16FNO/c1-8-6-10(13)11(15)7-9(8)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3
InChIKeyQAUZTXVUTOOKTE-UHFFFAOYSA-N
XLogP2.57
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminocyclopentyl)-4-fluoro-5-methylphenol
CID 117298959
1-(4,5-difluoro-2-methylphenyl)cyclopropan-1-amine
CID 84768959
1-(4-fluoro-5-methoxy-2-methylphenyl)cyclopentan-1-amine
CID 84789200
1-(4-chloro-5-fluoro-2-methylphenyl)cyclopentan-1-amine
CID 84791905
5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol
CID 117323526
5-(1-aminocyclopentyl)-2-methyl-4-methylsulfanylphenol
CID 117347766
1-(5-ethyl-4-fluoro-2-methylphenyl)cyclobutan-1-amine
CID 117296588
1-(5-fluoro-4-hydroxy-2-methylphenyl)cyclopentane-1-carboxylic acid
CID 84799147
4-(1-aminocyclopropyl)-2,5-difluorophenol
CID 117280020
2-(1-aminocyclohexyl)-6-fluoro-4-methylphenol
CID 117320128
5-(1-aminocyclobutyl)-2-methyl-4-methylsulfanylphenol
CID 117320752
1-(2-fluoro-4,5-dimethylphenyl)cyclopropan-1-amine
CID 84767927

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol?
The IUPAC name of 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol (CID 84780716) is 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol.
What is the SMILES notation for 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol?
The canonical SMILES for 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol is Cc1cc(F)c(O)cc1C1(N)CCCC1.
What is the InChIKey of 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol?
The InChIKey is QAUZTXVUTOOKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-8-6-10(13)11(15)7-9(8)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3.
What are the key properties of 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol?
5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol has a molecular weight of 209.26 g/mol, XLogP of 2.57, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol is sourced from PubChem (CID 84780716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).