1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine

C15H22FN — CID 107411471

IUPAC1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
SMILESCC1CCC(CNC(C)c2ccccc2F)C1
InChIInChI=1S/C15H22FN/c1-11-7-8-13(9-11)10-17-12(2)14-5-3-4-6-15(14)16/h3-6,11-13,17H,7-10H2,1-2H3
InChIKeyLAWAINGGOWIIPK-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.91
Rot. Bonds4

About 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine

1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine (PubChem CID 107411471) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
PubChem CID107411471
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Name1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
SMILESCC1CCC(CNC(C)c2ccccc2F)C1
InChIInChI=1S/C15H22FN/c1-11-7-8-13(9-11)10-17-12(2)14-5-3-4-6-15(14)16/h3-6,11-13,17H,7-10H2,1-2H3
InChIKeyLAWAINGGOWIIPK-UHFFFAOYSA-N
XLogP3.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-methylcyclopentyl)methyl]-1-(2-methylphenyl)ethanamine
CID 107411455
N-[(4-tert-butylcyclohexyl)methyl]-1-(2-fluorophenyl)ethanamine
CID 104574961
1-(4-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
CID 107411910
(1R)-1-(2-fluorophenyl)-N-[(1-methylpiperidin-4-yl)methyl]ethanamine
CID 81379999
N-[(3,5-dimethylcyclohex-3-en-1-yl)methyl]-1-(2-fluorophenyl)ethanamine
CID 103276554
3-fluoro-4-[1-[(4-methylcyclohexyl)methylamino]ethyl]phenol
CID 107715127
1-(4-bromo-2-fluorophenyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 82963551
(1S)-1-(2-methoxyphenyl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 81397121
(1R)-1-(2-bromophenyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 81378377
(2R)-1-[4-[[[(1S)-1-(2-fluorophenyl)ethyl]amino]methyl]piperidin-1-yl]propan-2-ol
CID 95293335
1-(3,4-difluorophenyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 55192396
(1R)-1-(3-fluorophenyl)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 81369388

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine (CID 107411471) is 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine is CC1CCC(CNC(C)c2ccccc2F)C1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The InChIKey is LAWAINGGOWIIPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-11-7-8-13(9-11)10-17-12(2)14-5-3-4-6-15(14)16/h3-6,11-13,17H,7-10H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine has a molecular weight of 235.35 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine is sourced from PubChem (CID 107411471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).