N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide

C11H16N2O2 — CID 57261470

IUPACN-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide
SMILESCC(=O)Nc1ccc([C@@H]2CCCN2C)o1
InChIInChI=1S/C11H16N2O2/c1-8(14)12-11-6-5-10(15-11)9-4-3-7-13(9)2/h5-6,9H,3-4,7H2,1-2H3,(H,12,14)/t9-/m0/s1
InChIKeyGPDPUYRBSNOPOR-VIFPVBQESA-N
MW208.26 g/mol
LogP2.00
Rot. Bonds2

About N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide

N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide (PubChem CID 57261470) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide
PubChem CID57261470
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide
SMILESCC(=O)Nc1ccc([C@@H]2CCCN2C)o1
InChIInChI=1S/C11H16N2O2/c1-8(14)12-11-6-5-10(15-11)9-4-3-7-13(9)2/h5-6,9H,3-4,7H2,1-2H3,(H,12,14)/t9-/m0/s1
InChIKeyGPDPUYRBSNOPOR-VIFPVBQESA-N
XLogP2.00
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide?
The IUPAC name of N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide (CID 57261470) is N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide.
What is the SMILES notation for N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide?
The canonical SMILES for N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide is CC(=O)Nc1ccc([C@@H]2CCCN2C)o1.
What is the InChIKey of N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide?
The InChIKey is GPDPUYRBSNOPOR-VIFPVBQESA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8(14)12-11-6-5-10(15-11)9-4-3-7-13(9)2/h5-6,9H,3-4,7H2,1-2H3,(H,12,14)/t9-/m0/s1.
What are the key properties of N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide?
N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide has a molecular weight of 208.26 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2S)-1-methylpyrrolidin-2-yl]furan-2-yl]acetamide is sourced from PubChem (CID 57261470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).