N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine

C17H26FN — CID 65410648

IUPACN-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine
SMILESCCCNC(c1ccccc1F)C1CCC(CC)C1
InChIInChI=1S/C17H26FN/c1-3-11-19-17(14-10-9-13(4-2)12-14)15-7-5-6-8-16(15)18/h5-8,13-14,17,19H,3-4,9-12H2,1-2H3
InChIKeyWXEIUNHSNMCDLZ-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.69
Rot. Bonds6

About N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine

N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine (PubChem CID 65410648) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine
PubChem CID65410648
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC NameN-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine
SMILESCCCNC(c1ccccc1F)C1CCC(CC)C1
InChIInChI=1S/C17H26FN/c1-3-11-19-17(14-10-9-13(4-2)12-14)15-7-5-6-8-16(15)18/h5-8,13-14,17,19H,3-4,9-12H2,1-2H3
InChIKeyWXEIUNHSNMCDLZ-UHFFFAOYSA-N
XLogP4.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2,6-difluorophenyl)-(3-ethylcyclopentyl)methyl]propan-1-amine
CID 65409865
N-[(3-ethylcyclopentyl)-phenylmethyl]propan-1-amine
CID 65412412
N-[(3-ethylcyclopentyl)-(2-fluoro-3-methoxyphenyl)methyl]propan-1-amine
CID 82791518
N-[(3-ethylcyclohexyl)-(2-ethylphenyl)methyl]propan-1-amine
CID 104992292
N-[(4-bromo-2-fluorophenyl)-(3-ethylcyclohexyl)methyl]propan-1-amine
CID 114906767
N-[(3-ethylcyclopentyl)-(2,4,5-trimethylphenyl)methyl]propan-1-amine
CID 65409670
N-[(3-ethylcyclopentyl)-(4-methylphenyl)methyl]propan-1-amine
CID 65410254
N-[(3-ethylcyclopentyl)-(4-methoxy-2-methylphenyl)methyl]propan-1-amine
CID 65410252
N-[cyclopropyl-(2-fluoro-5-methylphenyl)methyl]propan-1-amine
CID 62789509
N-[(3-ethylcyclopentyl)-(3-fluoro-4-pyridinyl)methyl]ethanamine
CID 113447257
N-[2-cyclohexyl-1-(2-fluorophenyl)ethyl]propan-1-amine
CID 55186438
N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine
CID 65411816

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine?
The IUPAC name of N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine (CID 65410648) is N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine?
The canonical SMILES for N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine is CCCNC(c1ccccc1F)C1CCC(CC)C1.
What is the InChIKey of N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine?
The InChIKey is WXEIUNHSNMCDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-3-11-19-17(14-10-9-13(4-2)12-14)15-7-5-6-8-16(15)18/h5-8,13-14,17,19H,3-4,9-12H2,1-2H3.
What are the key properties of N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine?
N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine has a molecular weight of 263.40 g/mol, XLogP of 4.69, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylcyclopentyl)-(2-fluorophenyl)methyl]propan-1-amine is sourced from PubChem (CID 65410648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).