(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine

C10H15NO — CID 24894516

IUPAC(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine
SMILESCc1ccc([C@@H]2CCCN2C)o1
InChIInChI=1S/C10H15NO/c1-8-5-6-10(12-8)9-4-3-7-11(9)2/h5-6,9H,3-4,7H2,1-2H3/t9-/m0/s1
InChIKeyNTRCVGKENRJOLL-VIFPVBQESA-N
MW165.24 g/mol
LogP2.35
Rot. Bonds1

About (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine

(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine (PubChem CID 24894516) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine.

Molecular Properties

Compound Name(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine
PubChem CID24894516
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine
SMILESCc1ccc([C@@H]2CCCN2C)o1
InChIInChI=1S/C10H15NO/c1-8-5-6-10(12-8)9-4-3-7-11(9)2/h5-6,9H,3-4,7H2,1-2H3/t9-/m0/s1
InChIKeyNTRCVGKENRJOLL-VIFPVBQESA-N
XLogP2.35
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine?
The IUPAC name of (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine (CID 24894516) is (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine.
What is the SMILES notation for (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine?
The canonical SMILES for (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine is Cc1ccc([C@@H]2CCCN2C)o1.
What is the InChIKey of (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine?
The InChIKey is NTRCVGKENRJOLL-VIFPVBQESA-N. The full InChI is InChI=1S/C10H15NO/c1-8-5-6-10(12-8)9-4-3-7-11(9)2/h5-6,9H,3-4,7H2,1-2H3/t9-/m0/s1.
What are the key properties of (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine?
(2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine has a molecular weight of 165.24 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-methyl-2-(5-methylfuran-2-yl)pyrrolidine is sourced from PubChem (CID 24894516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).