2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide

C16H23N3O — CID 64618361

IUPAC2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide
SMILESO=C(CC1CNC1)NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C16H23N3O/c20-16(8-14-9-17-10-14)18-15-6-7-19(12-15)11-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2,(H,18,20)
InChIKeyREKSTZRTTRIJRO-UHFFFAOYSA-N
MW273.38 g/mol
LogP0.99
Rot. Bonds5

About 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide

2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide (PubChem CID 64618361) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide
PubChem CID64618361
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide
SMILESO=C(CC1CNC1)NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C16H23N3O/c20-16(8-14-9-17-10-14)18-15-6-7-19(12-15)11-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2,(H,18,20)
InChIKeyREKSTZRTTRIJRO-UHFFFAOYSA-N
XLogP0.99
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(3R)-1-benzylpyrrolidin-3-yl]acetamide
CID 93027730
N-(1-benzylpyrrolidin-3-yl)pyrrolidine-3-carboxamide
CID 63005959
2-(azepan-1-yl)-N-[(3S)-1-benzylpyrrolidin-3-yl]acetamide
CID 131913098
N-[(3R)-1-benzylpyrrolidin-3-yl]-4-phenylbutanamide
CID 51947538
N-(1-benzylpyrrolidin-3-yl)-3-(ethylamino)propanamide
CID 62833579
N-[(3S)-1-benzylpyrrolidin-3-yl]-2,2-dimethylpropanamide
CID 94785030
(3S,4R)-3-N-(1-benzylpyrrolidin-3-yl)-4-N-(2-phenylethyl)pyrrolidine-3,4-dicarboxamide
CID 70690145
N-(1-benzylpyrrolidin-3-yl)piperidine-4-carboxamide;dihydrochloride
CID 119831668
N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(3-fluorophenyl)acetamide
CID 39959483
N-(1-benzylpiperidin-3-yl)-2-pyrrolidin-2-ylacetamide
CID 119856028
N-(1-benzylpyrrolidin-3-yl)-3-[1-(2-hydroxyethyl)piperidin-4-yl]propanamide
CID 72937332
2-amino-N-(1-benzylpyrrolidin-3-yl)-2-methylpentanamide
CID 60847713

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide (CID 64618361) is 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide is O=C(CC1CNC1)NC1CCN(Cc2ccccc2)C1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide?
The InChIKey is REKSTZRTTRIJRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c20-16(8-14-9-17-10-14)18-15-6-7-19(12-15)11-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2,(H,18,20).
What are the key properties of 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide?
2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide has a molecular weight of 273.38 g/mol, XLogP of 0.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 64618361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).