2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide

C8H16N2O — CID 121479469

IUPAC2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide
SMILESC[C@@H]1CCN(C)C1CC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-3-4-10(2)7(6)5-8(9)11/h6-7H,3-5H2,1-2H3,(H2,9,11)/t6-,7?/m1/s1
InChIKeyAMMWNUONSVDPLY-ULUSZKPHSA-N
MW156.23 g/mol
LogP0.20
Rot. Bonds2

About 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide

2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide (PubChem CID 121479469) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide
PubChem CID121479469
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide
SMILESC[C@@H]1CCN(C)C1CC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-3-4-10(2)7(6)5-8(9)11/h6-7H,3-5H2,1-2H3,(H2,9,11)/t6-,7?/m1/s1
InChIKeyAMMWNUONSVDPLY-ULUSZKPHSA-N
XLogP0.20
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide?
The IUPAC name of 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide (CID 121479469) is 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide.
What is the SMILES notation for 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide?
The canonical SMILES for 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide is C[C@@H]1CCN(C)C1CC(N)=O.
What is the InChIKey of 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide?
The InChIKey is AMMWNUONSVDPLY-ULUSZKPHSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-3-4-10(2)7(6)5-8(9)11/h6-7H,3-5H2,1-2H3,(H2,9,11)/t6-,7?/m1/s1.
What are the key properties of 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide?
2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide has a molecular weight of 156.23 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1,3-dimethylpyrrolidin-2-yl]acetamide is sourced from PubChem (CID 121479469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).