1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine

C14H20FNO — CID 114058866

IUPAC1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine
SMILESCNC(C)c1cccc(F)c1OC1CCCC1
InChIInChI=1S/C14H20FNO/c1-10(16-2)12-8-5-9-13(15)14(12)17-11-6-3-4-7-11/h5,8-11,16H,3-4,6-7H2,1-2H3
InChIKeyCEKPQPMZMOJGFS-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.43
Rot. Bonds4

About 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine

1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine (PubChem CID 114058866) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine
PubChem CID114058866
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine
SMILESCNC(C)c1cccc(F)c1OC1CCCC1
InChIInChI=1S/C14H20FNO/c1-10(16-2)12-8-5-9-13(15)14(12)17-11-6-3-4-7-11/h5,8-11,16H,3-4,6-7H2,1-2H3
InChIKeyCEKPQPMZMOJGFS-UHFFFAOYSA-N
XLogP3.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclohexyloxyphenyl)-N-methylethanamine
CID 43279544
1-[3-fluoro-2-(4-methylcyclohexyl)oxyphenyl]ethanamine
CID 114058879
1-chloro-2-cyclopentyloxy-3-fluorobenzene
CID 130057769
1-[2-fluoro-6-(3-methylcyclohexyl)oxyphenyl]-N-methylethanamine
CID 43285864
(1R)-1-(3-cyclopentyloxy-4-fluorophenyl)-N-methylethanamine
CID 142399949
3-(2-cyclopentyloxy-3-fluoroanilino)propane-1,2-diol
CID 168595650
(2-cyclopentyloxy-3-fluorophenyl)methanol
CID 112613227
1-[3-fluoro-2-(2-methylpentoxy)phenyl]-N-methylethanamine
CID 114058958
1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine
CID 113389061
(1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine
CID 93007238
N-(2-cyclopentyloxyethyl)-1-(2,3-difluorophenyl)ethanamine
CID 103924748
N-[[3-fluoro-2-(4-methylcyclohexyl)oxyphenyl]methyl]propan-2-amine
CID 115955018

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine?
The IUPAC name of 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine (CID 114058866) is 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine.
What is the SMILES notation for 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine?
The canonical SMILES for 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine is CNC(C)c1cccc(F)c1OC1CCCC1.
What is the InChIKey of 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine?
The InChIKey is CEKPQPMZMOJGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-10(16-2)12-8-5-9-13(15)14(12)17-11-6-3-4-7-11/h5,8-11,16H,3-4,6-7H2,1-2H3.
What are the key properties of 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine?
1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine has a molecular weight of 237.32 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine is sourced from PubChem (CID 114058866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).