[3-(2-fluorocyclopentyl)phenyl]methanamine

C12H16FN — CID 115019498

IUPAC[3-(2-fluorocyclopentyl)phenyl]methanamine
SMILESNCc1cccc(C2CCCC2F)c1
InChIInChI=1S/C12H16FN/c13-12-6-2-5-11(12)10-4-1-3-9(7-10)8-14/h1,3-4,7,11-12H,2,5-6,8,14H2
InChIKeyMXFLCPPZPNDRPL-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.75
Rot. Bonds2

About [3-(2-fluorocyclopentyl)phenyl]methanamine

[3-(2-fluorocyclopentyl)phenyl]methanamine (PubChem CID 115019498) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is [3-(2-fluorocyclopentyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2-fluorocyclopentyl)phenyl]methanamine
PubChem CID115019498
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name[3-(2-fluorocyclopentyl)phenyl]methanamine
SMILESNCc1cccc(C2CCCC2F)c1
InChIInChI=1S/C12H16FN/c13-12-6-2-5-11(12)10-4-1-3-9(7-10)8-14/h1,3-4,7,11-12H,2,5-6,8,14H2
InChIKeyMXFLCPPZPNDRPL-UHFFFAOYSA-N
XLogP2.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(2-fluorocyclopropyl)phenyl]methanamine
CID 115013049
[3-(4-ethylcycloheptyl)phenyl]methanamine
CID 123307972
(3-piperidin-3-ylphenyl)methanamine
CID 82603658
2-(3-cyclobutylphenyl)ethanamine
CID 83827556
[4-[2-(3-cyclopropylphenyl)cyclopropyl]phenyl]methanamine
CID 70968876
[3-(aminomethyl)phenyl]methanamine;azane
CID 175725248
[3-(3-fluorocyclohexyl)phenyl]methanol
CID 115025868
[(3S,4S)-4-[3-(aminomethyl)phenyl]-1-benzylpyrrolidin-3-yl]methanamine
CID 10108566
4-(3-cyclopentylphenyl)butan-1-amine
CID 117310057
CID 174402898
CID 174402898
[3-(2-cyclopropylethynyl)phenyl]methanamine
CID 122242647
3-(2-methylcyclopentyl)aniline
CID 165463165

Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorocyclopentyl)phenyl]methanamine?
The IUPAC name of [3-(2-fluorocyclopentyl)phenyl]methanamine (CID 115019498) is [3-(2-fluorocyclopentyl)phenyl]methanamine.
What is the SMILES notation for [3-(2-fluorocyclopentyl)phenyl]methanamine?
The canonical SMILES for [3-(2-fluorocyclopentyl)phenyl]methanamine is NCc1cccc(C2CCCC2F)c1.
What is the InChIKey of [3-(2-fluorocyclopentyl)phenyl]methanamine?
The InChIKey is MXFLCPPZPNDRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c13-12-6-2-5-11(12)10-4-1-3-9(7-10)8-14/h1,3-4,7,11-12H,2,5-6,8,14H2.
What are the key properties of [3-(2-fluorocyclopentyl)phenyl]methanamine?
[3-(2-fluorocyclopentyl)phenyl]methanamine has a molecular weight of 193.27 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorocyclopentyl)phenyl]methanamine is sourced from PubChem (CID 115019498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).