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

C12H16FNO2 — CID 117323526

IUPAC5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol
SMILESCOc1cc(F)c(C2(N)CCCC2)cc1O
InChIInChI=1S/C12H16FNO2/c1-16-11-7-9(13)8(6-10(11)15)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3
InChIKeyPCSWWPZBLXAFHC-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.27
Rot. Bonds2

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

5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol (PubChem CID 117323526) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol.

Molecular Properties

Compound Name5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol
PubChem CID117323526
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol
SMILESCOc1cc(F)c(C2(N)CCCC2)cc1O
InChIInChI=1S/C12H16FNO2/c1-16-11-7-9(13)8(6-10(11)15)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3
InChIKeyPCSWWPZBLXAFHC-UHFFFAOYSA-N
XLogP2.27
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-difluoro-4-methoxyphenyl)cyclobutan-1-amine
CID 117303916
1-(4-fluoro-5-methoxy-2-methylphenyl)cyclopentan-1-amine
CID 84789200
2-(1-aminocyclopentyl)-4-methoxy-5-methylphenol
CID 117316532
5-(1-aminocyclopentyl)-2-fluoro-4-methylphenol
CID 84780716
1-(4-fluoro-2-methoxy-5-propan-2-ylphenyl)cyclohexan-1-amine
CID 117418048
1-(4-fluoro-2-methoxyphenyl)cyclopentan-1-amine
CID 82612097
4-(1-aminocyclohexyl)-2-bromo-5-fluorophenol
CID 84814370
2-(1-aminocyclopropyl)-4-hydroxy-5-methoxybenzoic acid
CID 105480283
2-(1-aminocyclohexyl)-5-chloro-4-methoxyphenol
CID 117392379
5-(1-aminocyclobutyl)-2-tert-butyl-4-methoxyphenol
CID 117377061
2-(1-aminocyclopentyl)-4-fluoro-5-methylphenol
CID 117298959
4-(1-aminocyclopropyl)-2,5-difluorophenol
CID 117280020

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol?
The IUPAC name of 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol (CID 117323526) is 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol.
What is the SMILES notation for 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol?
The canonical SMILES for 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol is COc1cc(F)c(C2(N)CCCC2)cc1O.
What is the InChIKey of 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol?
The InChIKey is PCSWWPZBLXAFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-16-11-7-9(13)8(6-10(11)15)12(14)4-2-3-5-12/h6-7,15H,2-5,14H2,1H3.
What are the key properties of 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol?
5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol has a molecular weight of 225.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminocyclopentyl)-4-fluoro-2-methoxyphenol is sourced from PubChem (CID 117323526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).