2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine

C13H18FNO — CID 82782828

IUPAC2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine
SMILESCNC1CCCC1c1cc(F)ccc1OC
InChIInChI=1S/C13H18FNO/c1-15-12-5-3-4-10(12)11-8-9(14)6-7-13(11)16-2/h6-8,10,12,15H,3-5H2,1-2H3
InChIKeyMAIPLTJMVMRGCC-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.69
Rot. Bonds3

About 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine

2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine (PubChem CID 82782828) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine
PubChem CID82782828
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine
SMILESCNC1CCCC1c1cc(F)ccc1OC
InChIInChI=1S/C13H18FNO/c1-15-12-5-3-4-10(12)11-8-9(14)6-7-13(11)16-2/h6-8,10,12,15H,3-5H2,1-2H3
InChIKeyMAIPLTJMVMRGCC-UHFFFAOYSA-N
XLogP2.69
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(5-fluoro-2-methoxyphenyl)cycloheptan-1-amine
CID 82783172
2-(2-fluoro-3-methoxyphenyl)-N-methylcyclopentan-1-amine
CID 82811854
2-cyclopentyl-4-fluoro-1-methoxybenzene
CID 67457026
[2-(5-fluoro-2-methoxyphenyl)cyclohexyl]methanamine
CID 82782278
2-(3-bromo-2,4-dimethoxyphenyl)-N-methylcyclopentan-1-amine
CID 103523805
2-(5-fluoro-2-methoxyphenyl)cycloheptane-1-carboxylic acid
CID 82782977
2-(3,4-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 62801123
2-(2,6-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 116811017
2-(2,4-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 62802296
1-[2-(5-fluoro-2-methoxyphenyl)-4-methylcyclohexyl]-N-methylmethanamine
CID 82782631
(2S)-2-(5-fluoro-2-methoxyphenyl)pyrrolidine
CID 55277653
N-[[2-(5-fluoro-2-methoxyphenyl)cyclobutyl]methyl]propan-1-amine
CID 82782284

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine?
The IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine (CID 82782828) is 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine is CNC1CCCC1c1cc(F)ccc1OC.
What is the InChIKey of 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine?
The InChIKey is MAIPLTJMVMRGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-15-12-5-3-4-10(12)11-8-9(14)6-7-13(11)16-2/h6-8,10,12,15H,3-5H2,1-2H3.
What are the key properties of 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine?
2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine has a molecular weight of 223.29 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methoxyphenyl)-N-methylcyclopentan-1-amine is sourced from PubChem (CID 82782828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).