(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine

C9H13NOS — CID 130641802

IUPAC(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine
SMILESCOc1sccc1[C@@H]1CCCN1
InChIInChI=1S/C9H13NOS/c1-11-9-7(4-6-12-9)8-3-2-5-10-8/h4,6,8,10H,2-3,5H2,1H3/t8-/m0/s1
InChIKeyLVQDUNVUBMWXAJ-QMMMGPOBSA-N
MW183.28 g/mol
LogP2.18
Rot. Bonds2

About (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine

(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine (PubChem CID 130641802) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine.

Molecular Properties

Compound Name(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine
PubChem CID130641802
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine
SMILESCOc1sccc1[C@@H]1CCCN1
InChIInChI=1S/C9H13NOS/c1-11-9-7(4-6-12-9)8-3-2-5-10-8/h4,6,8,10H,2-3,5H2,1H3/t8-/m0/s1
InChIKeyLVQDUNVUBMWXAJ-QMMMGPOBSA-N
XLogP2.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2R)-pyrrolidin-2-yl]thiophen-2-ol
CID 130642427
(2R)-2-(2-methoxyphenyl)pyrrolidine
CID 7047810
3-[(2S)-piperidin-2-yl]thiophen-2-amine
CID 130664785
4-methoxy-3-[(2R)-pyrrolidin-2-yl]aniline
CID 66518354
6-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]pyridine
CID 55273653
(2S)-2-(2-chloro-3-methoxyphenyl)pyrrolidine
CID 130973106
2-(2-chloro-3-methoxyphenyl)pyrrolidine
CID 83703297
2-(3-methoxynaphthalen-2-yl)pyrrolidine
CID 4540361
4-methoxy-3-pyrrolidin-2-ylphenol
CID 55297215
(2R)-2-(2-iodo-5-methoxyphenyl)pyrrolidine
CID 130676134
(2S)-2-(5-fluoro-2-methoxyphenyl)pyrrolidine
CID 55277653
5-methoxy-2-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195842

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine?
The IUPAC name of (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine (CID 130641802) is (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine.
What is the SMILES notation for (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine?
The canonical SMILES for (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine is COc1sccc1[C@@H]1CCCN1.
What is the InChIKey of (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine?
The InChIKey is LVQDUNVUBMWXAJ-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H13NOS/c1-11-9-7(4-6-12-9)8-3-2-5-10-8/h4,6,8,10H,2-3,5H2,1H3/t8-/m0/s1.
What are the key properties of (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine?
(2S)-2-(2-methoxythiophen-3-yl)pyrrolidine has a molecular weight of 183.28 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-methoxythiophen-3-yl)pyrrolidine is sourced from PubChem (CID 130641802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).