(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine

C10H15NOS — CID 107781606

IUPAC(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine
SMILESCc1occc1SC[C@H]1CCCN1
InChIInChI=1S/C10H15NOS/c1-8-10(4-6-12-8)13-7-9-3-2-5-11-9/h4,6,9,11H,2-3,5,7H2,1H3/t9-/m1/s1
InChIKeyYCZOAGWBPDOABP-SECBINFHSA-N
MW197.30 g/mol
LogP2.43
Rot. Bonds3

About (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine

(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine (PubChem CID 107781606) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine
PubChem CID107781606
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine
SMILESCc1occc1SC[C@H]1CCCN1
InChIInChI=1S/C10H15NOS/c1-8-10(4-6-12-8)13-7-9-3-2-5-11-9/h4,6,9,11H,2-3,5,7H2,1H3/t9-/m1/s1
InChIKeyYCZOAGWBPDOABP-SECBINFHSA-N
XLogP2.43
TPSA25.17 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 ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylfuran-3-yl)sulfanylmethyl]piperidine
CID 107781623
(2R)-2-[(2,4-dimethylphenyl)sulfanylmethyl]pyrrolidine
CID 102820293
2-[(4-methylphenyl)sulfanylmethyl]pyrrolidine;hydrochloride
CID 72716499
4,5-dimethyl-2-[[(2R)-pyrrolidin-2-yl]methylsulfanyl]-1,3-oxazole
CID 106924606
3-methoxy-4-[[(2R)-pyrrolidin-2-yl]methylsulfanyl]aniline
CID 102820443
3-bromo-4-(pyrrolidin-2-ylmethylsulfanyl)aniline
CID 82840688
3-bromo-4-[[(2R)-pyrrolidin-2-yl]methylsulfanyl]aniline
CID 102820462
5-methyl-2-(pyrrolidin-2-ylmethylsulfanyl)pyridine
CID 71638847
4-chloro-3-[[(2S)-pyrrolidin-2-yl]methylsulfanyl]aniline
CID 102820415
4-(2-methylfuran-3-yl)sulfanylazepane
CID 126974899
2-(2-methylfuran-3-yl)pyrrolidine
CID 82594864
(2S)-2-[(3-methylphenyl)methylsulfanylmethyl]pyrrolidine
CID 102820351

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine?
The IUPAC name of (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine (CID 107781606) is (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine.
What is the SMILES notation for (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine?
The canonical SMILES for (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine is Cc1occc1SC[C@H]1CCCN1.
What is the InChIKey of (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine?
The InChIKey is YCZOAGWBPDOABP-SECBINFHSA-N. The full InChI is InChI=1S/C10H15NOS/c1-8-10(4-6-12-8)13-7-9-3-2-5-11-9/h4,6,9,11H,2-3,5,7H2,1H3/t9-/m1/s1.
What are the key properties of (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine?
(2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine has a molecular weight of 197.30 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2-methylfuran-3-yl)sulfanylmethyl]pyrrolidine is sourced from PubChem (CID 107781606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).