N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine

C17H26FN — CID 65411816

IUPACN-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cc(F)ccc1C)C1CCC(CC)C1
InChIInChI=1S/C17H26FN/c1-4-13-7-8-14(10-13)17(19-5-2)16-11-15(18)9-6-12(16)3/h6,9,11,13-14,17,19H,4-5,7-8,10H2,1-3H3
InChIKeyYEOVVDCSJFYFMT-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.61
Rot. Bonds5

About N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine

N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine (PubChem CID 65411816) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine
PubChem CID65411816
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC NameN-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cc(F)ccc1C)C1CCC(CC)C1
InChIInChI=1S/C17H26FN/c1-4-13-7-8-14(10-13)17(19-5-2)16-11-15(18)9-6-12(16)3/h6,9,11,13-14,17,19H,4-5,7-8,10H2,1-3H3
InChIKeyYEOVVDCSJFYFMT-UHFFFAOYSA-N
XLogP4.61
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 ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3,4-dimethylphenyl)-(3-ethylcyclopentyl)methyl]ethanamine
CID 65411811
N-ethyl-1-(3-ethylcyclopentyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105374013
N-[(5-fluoro-2-methylphenyl)-(2-methylcyclopropyl)methyl]ethanamine
CID 65419979
N-[(3,4-dimethylcyclohexyl)-(5-fluoro-2-methylphenyl)methyl]propan-1-amine
CID 64740441
N-[(3-ethylcyclopentyl)-(2,4,5-trimethylphenyl)methyl]propan-1-amine
CID 65409670
N-[(3-ethylcyclopentyl)-(3-fluoro-4-pyridinyl)methyl]ethanamine
CID 113447257
N-[cyclopentyl-(5-fluoro-2-methylphenyl)methyl]propan-1-amine
CID 55187563
N-ethyl-1-(5-fluoro-2-methylphenyl)-2-(thian-4-yl)ethanamine
CID 105142551
N-[(5-fluoro-2-methylphenyl)-(oxolan-2-yl)methyl]ethanamine
CID 65328698
N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine
CID 65411617
1-(3-ethylcyclohexyl)-1-(4-fluoro-2-methylphenyl)-N-methylmethanamine
CID 65415754
N-[cyclohexyl-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 55187562

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine?
The IUPAC name of N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine (CID 65411816) is N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine is CCNC(c1cc(F)ccc1C)C1CCC(CC)C1.
What is the InChIKey of N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine?
The InChIKey is YEOVVDCSJFYFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-4-13-7-8-14(10-13)17(19-5-2)16-11-15(18)9-6-12(16)3/h6,9,11,13-14,17,19H,4-5,7-8,10H2,1-3H3.
What are the key properties of N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine?
N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine has a molecular weight of 263.40 g/mol, XLogP of 4.61, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 65411816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).