1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine

C15H25NS2 — CID 65140219

IUPAC1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine
SMILESCCCNC(CSC1CCCC1)Cc1cccs1
InChIInChI=1S/C15H25NS2/c1-2-9-16-13(11-15-8-5-10-17-15)12-18-14-6-3-4-7-14/h5,8,10,13-14,16H,2-4,6-7,9,11-12H2,1H3
InChIKeyGMDIFNRMYKECFI-UHFFFAOYSA-N
MW283.51 g/mol
LogP4.33
Rot. Bonds8

About 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine

1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine (PubChem CID 65140219) has the molecular formula C15H25NS2 and a molecular weight of 283.51 g/mol. Its IUPAC name is 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine
PubChem CID65140219
Molecular FormulaC15H25NS2
Molecular Weight283.51 g/mol
Exact Mass283.14
IUPAC Name1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine
SMILESCCCNC(CSC1CCCC1)Cc1cccs1
InChIInChI=1S/C15H25NS2/c1-2-9-16-13(11-15-8-5-10-17-15)12-18-14-6-3-4-7-14/h5,8,10,13-14,16H,2-4,6-7,9,11-12H2,1H3
InChIKeyGMDIFNRMYKECFI-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.51
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine?
The IUPAC name of 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine (CID 65140219) is 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine?
The canonical SMILES for 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine is CCCNC(CSC1CCCC1)Cc1cccs1.
What is the InChIKey of 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine?
The InChIKey is GMDIFNRMYKECFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS2/c1-2-9-16-13(11-15-8-5-10-17-15)12-18-14-6-3-4-7-14/h5,8,10,13-14,16H,2-4,6-7,9,11-12H2,1H3.
What are the key properties of 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine?
1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine has a molecular weight of 283.51 g/mol, XLogP of 4.33, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfanyl-N-propyl-3-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 65140219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).