2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol

C12H16FNO — CID 82612123

IUPAC2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol
SMILESNCC1(c2cc(F)ccc2O)CCCC1
InChIInChI=1S/C12H16FNO/c13-9-3-4-11(15)10(7-9)12(8-14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2
InChIKeyWNPCOTKCTWKZND-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.30
Rot. Bonds2

About 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol

2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol (PubChem CID 82612123) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol
PubChem CID82612123
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol
SMILESNCC1(c2cc(F)ccc2O)CCCC1
InChIInChI=1S/C12H16FNO/c13-9-3-4-11(15)10(7-9)12(8-14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2
InChIKeyWNPCOTKCTWKZND-UHFFFAOYSA-N
XLogP2.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(aminomethyl)cyclopentyl]-4-fluoroaniline
CID 117047242
2-[1-(aminomethyl)cyclopentyl]-4,5-difluorophenol
CID 84791404
2-[1-(aminomethyl)cyclopentyl]-4-chlorophenol
CID 131368937
2-[1-(aminomethyl)cyclopentyl]-4-fluorobenzaldehyde
CID 117316027
2-[1-(aminomethyl)cyclohexyl]-4-methylphenol
CID 82615959
2-[1-(aminomethyl)cyclopentyl]-6-chloro-4-fluorophenol
CID 84802258
2-[1-(aminomethyl)cyclobutyl]-4-(difluoromethyl)phenol
CID 117326698
4-[1-(aminomethyl)cyclobutyl]-2-fluorobenzene-1,3-diol
CID 117301474
2-[1-(aminomethyl)cyclopentyl]-4-pyrrolidin-1-ylphenol
CID 117405590
[1-(5-fluoro-1-benzofuran-7-yl)cyclopentyl]methanamine
CID 117338306
2-[1-(aminomethyl)cyclopentyl]-4-nitrophenol
CID 117344881
[1-(4-fluoro-2-pyrrolidin-1-ylphenyl)cyclopentyl]methanamine
CID 117113346

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol?
The IUPAC name of 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol (CID 82612123) is 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol.
What is the SMILES notation for 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol?
The canonical SMILES for 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol is NCC1(c2cc(F)ccc2O)CCCC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol?
The InChIKey is WNPCOTKCTWKZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-9-3-4-11(15)10(7-9)12(8-14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2.
What are the key properties of 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol?
2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol has a molecular weight of 209.26 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol is sourced from PubChem (CID 82612123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).