(3S)-3-(thiophen-3-ylmethoxy)piperidine

C10H15NOS — CID 66247968

IUPAC(3S)-3-(thiophen-3-ylmethoxy)piperidine
SMILESc1cc(CO[C@H]2CCCNC2)cs1
InChIInChI=1S/C10H15NOS/c1-2-10(6-11-4-1)12-7-9-3-5-13-8-9/h3,5,8,10-11H,1-2,4,6-7H2/t10-/m0/s1
InChIKeyFFZNEQMTBSORCD-JTQLQIEISA-N
MW197.30 g/mol
LogP2.02
Rot. Bonds3

About (3S)-3-(thiophen-3-ylmethoxy)piperidine

(3S)-3-(thiophen-3-ylmethoxy)piperidine (PubChem CID 66247968) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is (3S)-3-(thiophen-3-ylmethoxy)piperidine.

Molecular Properties

Compound Name(3S)-3-(thiophen-3-ylmethoxy)piperidine
PubChem CID66247968
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name(3S)-3-(thiophen-3-ylmethoxy)piperidine
SMILESc1cc(CO[C@H]2CCCNC2)cs1
InChIInChI=1S/C10H15NOS/c1-2-10(6-11-4-1)12-7-9-3-5-13-8-9/h3,5,8,10-11H,1-2,4,6-7H2/t10-/m0/s1
InChIKeyFFZNEQMTBSORCD-JTQLQIEISA-N
XLogP2.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-(thiophen-3-ylmethoxy)piperidine?
The IUPAC name of (3S)-3-(thiophen-3-ylmethoxy)piperidine (CID 66247968) is (3S)-3-(thiophen-3-ylmethoxy)piperidine.
What is the SMILES notation for (3S)-3-(thiophen-3-ylmethoxy)piperidine?
The canonical SMILES for (3S)-3-(thiophen-3-ylmethoxy)piperidine is c1cc(CO[C@H]2CCCNC2)cs1.
What is the InChIKey of (3S)-3-(thiophen-3-ylmethoxy)piperidine?
The InChIKey is FFZNEQMTBSORCD-JTQLQIEISA-N. The full InChI is InChI=1S/C10H15NOS/c1-2-10(6-11-4-1)12-7-9-3-5-13-8-9/h3,5,8,10-11H,1-2,4,6-7H2/t10-/m0/s1.
What are the key properties of (3S)-3-(thiophen-3-ylmethoxy)piperidine?
(3S)-3-(thiophen-3-ylmethoxy)piperidine has a molecular weight of 197.30 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(thiophen-3-ylmethoxy)piperidine is sourced from PubChem (CID 66247968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).