N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine

C17H26FN — CID 105377271

IUPACN-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine
SMILESCCNC(Cc1cc(F)ccc1C)C1(C)CCCC1
InChIInChI=1S/C17H26FN/c1-4-19-16(17(3)9-5-6-10-17)12-14-11-15(18)8-7-13(14)2/h7-8,11,16,19H,4-6,9-10,12H2,1-3H3
InChIKeyVLZKEZQMIYBWFT-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.24
Rot. Bonds5

About N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine

N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine (PubChem CID 105377271) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine
PubChem CID105377271
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC NameN-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine
SMILESCCNC(Cc1cc(F)ccc1C)C1(C)CCCC1
InChIInChI=1S/C17H26FN/c1-4-19-16(17(3)9-5-6-10-17)12-14-11-15(18)8-7-13(14)2/h7-8,11,16,19H,4-6,9-10,12H2,1-3H3
InChIKeyVLZKEZQMIYBWFT-UHFFFAOYSA-N
XLogP4.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethyl]propan-1-amine
CID 105374194
2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanol
CID 105377576
2-(2-chloro-3-fluorophenyl)-N-ethyl-1-(1-methylcyclopentyl)ethanamine
CID 105032675
N-[2-(5-fluoro-2-methylphenyl)-1-(1-methoxycyclopentyl)ethyl]propan-1-amine
CID 105374330
1-cyclopropyl-N-ethyl-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373730
2-(2,3-dichlorophenyl)-N-ethyl-1-(1-methylcyclopentyl)ethanamine
CID 107312340
1-cyclohexyl-N-ethyl-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373724
1-cyclooctyl-N-ethyl-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105374209
2-(2-bromo-5-fluorophenyl)-N-methyl-1-(1-methylcyclopentyl)ethanamine
CID 115843879
N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(4-methylthiophen-3-yl)ethanamine
CID 105374183
2-(5-fluoro-2-methylphenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
CID 105374348
[2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethyl]hydrazine
CID 105253513

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The IUPAC name of N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine (CID 105377271) is N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The canonical SMILES for N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine is CCNC(Cc1cc(F)ccc1C)C1(C)CCCC1.
What is the InChIKey of N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The InChIKey is VLZKEZQMIYBWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-4-19-16(17(3)9-5-6-10-17)12-14-11-15(18)8-7-13(14)2/h7-8,11,16,19H,4-6,9-10,12H2,1-3H3.
What are the key properties of N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine?
N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine has a molecular weight of 263.40 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(1-methylcyclopentyl)ethanamine is sourced from PubChem (CID 105377271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).