2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine

C10H13ClFNS — CID 106634866

IUPAC2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine
SMILESFC(c1ccc(Cl)s1)C1CCCCN1
InChIInChI=1S/C10H13ClFNS/c11-9-5-4-8(14-9)10(12)7-3-1-2-6-13-7/h4-5,7,10,13H,1-3,6H2
InChIKeyAZISQKDWVFLDAG-UHFFFAOYSA-N
MW233.74 g/mol
LogP3.55
Rot. Bonds2

About 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine

2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine (PubChem CID 106634866) has the molecular formula C10H13ClFNS and a molecular weight of 233.74 g/mol. Its IUPAC name is 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine.

Molecular Properties

Compound Name2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine
PubChem CID106634866
Molecular FormulaC10H13ClFNS
Molecular Weight233.74 g/mol
Exact Mass233.04
IUPAC Name2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine
SMILESFC(c1ccc(Cl)s1)C1CCCCN1
InChIInChI=1S/C10H13ClFNS/c11-9-5-4-8(14-9)10(12)7-3-1-2-6-13-7/h4-5,7,10,13H,1-3,6H2
InChIKeyAZISQKDWVFLDAG-UHFFFAOYSA-N
XLogP3.55
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[1-(5-chlorothiophen-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine
CID 75428499
1-(5-Chlorothiophen-2-yl)propan-2-amine--hydrogen chloride (1/1)
CID 90673409
Ethylamine, 1-(5-chloro-2-thenyl)-, hydrochloride
CID 49889
1-(5-Chlorothiophen-2-yl)propan-2-amine
CID 49890
1-[(5-Chlorothiophen-2-yl)methyl]piperazine
CID 2455012
2-(5-Chloro-2-thienyl)pyrrolidine
CID 4305829
4-(5-Chlorothiophen-2-yl)butan-1-amine hydrochloride
CID 102555175
2-(5-Chlorothiophen-2-yl)pyrrolidine hydrochloride
CID 165715673
2-(5-Fluorothiophen-2-yl)piperidine
CID 130000757
2-(5-Chlorothiophen-2-yl)-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethanamine
CID 43362657
N-[(5-chlorothiophen-2-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 43434347
N-[(5-chlorothiophen-2-yl)methyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 43434442

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine?
The IUPAC name of 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine (CID 106634866) is 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine.
What is the SMILES notation for 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine?
The canonical SMILES for 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine is FC(c1ccc(Cl)s1)C1CCCCN1.
What is the InChIKey of 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine?
The InChIKey is AZISQKDWVFLDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClFNS/c11-9-5-4-8(14-9)10(12)7-3-1-2-6-13-7/h4-5,7,10,13H,1-3,6H2.
What are the key properties of 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine?
2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine has a molecular weight of 233.74 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chlorothiophen-2-yl)-fluoromethyl]piperidine is sourced from PubChem (CID 106634866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).