3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine

C10H14FNS — CID 112565762

IUPAC3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine
SMILESNC1CCC(F)(Cc2ccsc2)C1
InChIInChI=1S/C10H14FNS/c11-10(3-1-9(12)6-10)5-8-2-4-13-7-8/h2,4,7,9H,1,3,5-6,12H2
InChIKeySSEHSTLPWRLQSY-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.51
Rot. Bonds2

About 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine

3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine (PubChem CID 112565762) has the molecular formula C10H14FNS and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine
PubChem CID112565762
Molecular FormulaC10H14FNS
Molecular Weight199.29 g/mol
Exact Mass199.08
IUPAC Name3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine
SMILESNC1CCC(F)(Cc2ccsc2)C1
InChIInChI=1S/C10H14FNS/c11-10(3-1-9(12)6-10)5-8-2-4-13-7-8/h2,4,7,9H,1,3,5-6,12H2
InChIKeySSEHSTLPWRLQSY-UHFFFAOYSA-N
XLogP2.51
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine (CID 112565762) is 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine is NC1CCC(F)(Cc2ccsc2)C1.
What is the InChIKey of 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine?
The InChIKey is SSEHSTLPWRLQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNS/c11-10(3-1-9(12)6-10)5-8-2-4-13-7-8/h2,4,7,9H,1,3,5-6,12H2.
What are the key properties of 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine?
3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine has a molecular weight of 199.29 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(thiophen-3-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 112565762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).