1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine

C15H22FNS — CID 65138877

IUPAC1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine
SMILESCNC(CSC1CCCC1)Cc1ccc(F)cc1
InChIInChI=1S/C15H22FNS/c1-17-14(11-18-15-4-2-3-5-15)10-12-6-8-13(16)9-7-12/h6-9,14-15,17H,2-5,10-11H2,1H3
InChIKeyYJOGMUZDRIQQOT-UHFFFAOYSA-N
MW267.41 g/mol
LogP3.63
Rot. Bonds6

About 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine

1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine (PubChem CID 65138877) has the molecular formula C15H22FNS and a molecular weight of 267.41 g/mol. Its IUPAC name is 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine
PubChem CID65138877
Molecular FormulaC15H22FNS
Molecular Weight267.41 g/mol
Exact Mass267.15
IUPAC Name1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine
SMILESCNC(CSC1CCCC1)Cc1ccc(F)cc1
InChIInChI=1S/C15H22FNS/c1-17-14(11-18-15-4-2-3-5-15)10-12-6-8-13(16)9-7-12/h6-9,14-15,17H,2-5,10-11H2,1H3
InChIKeyYJOGMUZDRIQQOT-UHFFFAOYSA-N
XLogP3.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-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-cyclopentylsulfanyl-N-methyl-3-(4-propan-2-ylphenyl)propan-2-amine
CID 65138833
1-cyclohexylsulfanyl-3-(4-iodophenyl)-N-methylpropan-2-amine
CID 65479375
1-cyclohexylsulfanyl-3-(5-fluoro-2-methylphenyl)-N-methylpropan-2-amine
CID 105373963
1-cyclohexylsulfanyl-3-(4-fluorophenyl)propan-2-amine
CID 65139947
2-cyclopentylsulfanyl-1-(4-fluorophenyl)-N-methylethanamine
CID 65138724
1-(4-chloro-2-fluorophenyl)-3-cyclopentylsulfanyl-N-methylpropan-2-amine
CID 114855831
[1-cyclopentylsulfanyl-3-(4-methylphenyl)propan-2-yl]hydrazine
CID 105227574
1-cycloheptyl-2-(4-fluorophenyl)-N-methylethanamine
CID 55091488
1-cyclohexylsulfanyl-N-ethyl-3-phenylpropan-2-amine
CID 65144146
1-(4-chloro-3-fluorophenyl)-3-cyclopentylsulfanyl-N-ethylpropan-2-amine
CID 107884779
1-(5-chlorothiophen-2-yl)-3-cyclohexylsulfanyl-N-methylpropan-2-amine
CID 65139957
1-(4-fluorophenyl)-3-(2-fluorophenyl)sulfanyl-N-methylpropan-2-amine
CID 66051929

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine?
The IUPAC name of 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine (CID 65138877) is 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine?
The canonical SMILES for 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine is CNC(CSC1CCCC1)Cc1ccc(F)cc1.
What is the InChIKey of 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine?
The InChIKey is YJOGMUZDRIQQOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNS/c1-17-14(11-18-15-4-2-3-5-15)10-12-6-8-13(16)9-7-12/h6-9,14-15,17H,2-5,10-11H2,1H3.
What are the key properties of 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine?
1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine has a molecular weight of 267.41 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfanyl-3-(4-fluorophenyl)-N-methylpropan-2-amine is sourced from PubChem (CID 65138877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).