(2R)-2-(thiophen-2-ylmethyl)pyrrolidine

C9H13NS — CID 42076983

IUPAC(2R)-2-(thiophen-2-ylmethyl)pyrrolidine
SMILESc1csc(C[C@H]2CCCN2)c1
InChIInChI=1S/C9H13NS/c1-3-8(10-5-1)7-9-4-2-6-11-9/h2,4,6,8,10H,1,3,5,7H2/t8-/m1/s1
InChIKeyQESLZSQKJUJIJX-MRVPVSSYSA-N
MW167.28 g/mol
LogP2.04
Rot. Bonds2

About (2R)-2-(thiophen-2-ylmethyl)pyrrolidine

(2R)-2-(thiophen-2-ylmethyl)pyrrolidine (PubChem CID 42076983) has the molecular formula C9H13NS and a molecular weight of 167.28 g/mol. Its IUPAC name is (2R)-2-(thiophen-2-ylmethyl)pyrrolidine.

Molecular Properties

Compound Name(2R)-2-(thiophen-2-ylmethyl)pyrrolidine
PubChem CID42076983
Molecular FormulaC9H13NS
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC Name(2R)-2-(thiophen-2-ylmethyl)pyrrolidine
SMILESc1csc(C[C@H]2CCCN2)c1
InChIInChI=1S/C9H13NS/c1-3-8(10-5-1)7-9-4-2-6-11-9/h2,4,6,8,10H,1,3,5,7H2/t8-/m1/s1
InChIKeyQESLZSQKJUJIJX-MRVPVSSYSA-N
XLogP2.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(thiophen-2-ylmethyl)pyrrolidine?
The IUPAC name of (2R)-2-(thiophen-2-ylmethyl)pyrrolidine (CID 42076983) is (2R)-2-(thiophen-2-ylmethyl)pyrrolidine.
What is the SMILES notation for (2R)-2-(thiophen-2-ylmethyl)pyrrolidine?
The canonical SMILES for (2R)-2-(thiophen-2-ylmethyl)pyrrolidine is c1csc(C[C@H]2CCCN2)c1.
What is the InChIKey of (2R)-2-(thiophen-2-ylmethyl)pyrrolidine?
The InChIKey is QESLZSQKJUJIJX-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H13NS/c1-3-8(10-5-1)7-9-4-2-6-11-9/h2,4,6,8,10H,1,3,5,7H2/t8-/m1/s1.
What are the key properties of (2R)-2-(thiophen-2-ylmethyl)pyrrolidine?
(2R)-2-(thiophen-2-ylmethyl)pyrrolidine has a molecular weight of 167.28 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(thiophen-2-ylmethyl)pyrrolidine is sourced from PubChem (CID 42076983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).