1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine

C15H22FNO — CID 55018597

IUPAC1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine
SMILESCCC(N)C(OC1CCCC1)c1ccccc1F
InChIInChI=1S/C15H22FNO/c1-2-14(17)15(18-11-7-3-4-8-11)12-9-5-6-10-13(12)16/h5-6,9-11,14-15H,2-4,7-8,17H2,1H3
InChIKeyYOIBXSWDOPCSDE-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.56
Rot. Bonds5

About 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine

1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine (PubChem CID 55018597) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine.

Molecular Properties

Compound Name1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine
PubChem CID55018597
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine
SMILESCCC(N)C(OC1CCCC1)c1ccccc1F
InChIInChI=1S/C15H22FNO/c1-2-14(17)15(18-11-7-3-4-8-11)12-9-5-6-10-13(12)16/h5-6,9-11,14-15H,2-4,7-8,17H2,1H3
InChIKeyYOIBXSWDOPCSDE-UHFFFAOYSA-N
XLogP3.56
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine 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

1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
CID 106200053
2-cyclohexyloxy-2-(2-fluorophenyl)ethanamine
CID 55018547
1-(4-chlorophenyl)-1-cyclohexyloxybutan-2-amine
CID 55014714
1-(4-chlorophenyl)-1-cycloheptyloxybutan-2-amine
CID 63461230
1-(2-fluorophenyl)-1-[(2-fluorophenyl)methoxy]butan-2-amine
CID 63934055
1-(2-fluorophenyl)-1-octan-2-yloxybutan-2-amine
CID 63459546
1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine
CID 55022905
2-cycloheptyloxy-1-(2-fluorophenyl)ethanamine
CID 114058365
1-(3,3-dimethylbutoxy)-1-(2-fluorophenyl)butan-2-amine
CID 66233120
1-N-(cyclopentylmethyl)-1-(2-fluorophenyl)-1-N-methylbutane-1,2-diamine
CID 63633108
1-(4-bromophenyl)-1-cyclobutyloxybutan-2-amine
CID 62115253
1-(cyclohexylmethoxy)-1-(2-fluorophenyl)propan-2-amine
CID 62383305

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine?
The IUPAC name of 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine (CID 55018597) is 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine.
What is the SMILES notation for 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine?
The canonical SMILES for 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine is CCC(N)C(OC1CCCC1)c1ccccc1F.
What is the InChIKey of 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine?
The InChIKey is YOIBXSWDOPCSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-2-14(17)15(18-11-7-3-4-8-11)12-9-5-6-10-13(12)16/h5-6,9-11,14-15H,2-4,7-8,17H2,1H3.
What are the key properties of 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine?
1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine has a molecular weight of 251.34 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine is sourced from PubChem (CID 55018597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).