2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide

C15H21N3O — CID 64616785

IUPAC2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CC1CNC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C15H21N3O/c19-15(8-12-10-16-11-12)17-13-4-3-5-14(9-13)18-6-1-2-7-18/h3-5,9,12,16H,1-2,6-8,10-11H2,(H,17,19)
InChIKeyHCLGMTXUYGWVAH-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.83
Rot. Bonds4

About 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide

2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 64616785) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide
PubChem CID64616785
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CC1CNC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C15H21N3O/c19-15(8-12-10-16-11-12)17-13-4-3-5-14(9-13)18-6-1-2-7-18/h3-5,9,12,16H,1-2,6-8,10-11H2,(H,17,19)
InChIKeyHCLGMTXUYGWVAH-UHFFFAOYSA-N
XLogP1.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61030185
2-(azetidin-3-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 64617395
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 60928462
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61365428
N-(3-acetamidophenyl)-2-(azetidin-3-yl)acetamide
CID 64617559
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
3-[[2-(azetidin-3-yl)acetyl]amino]benzamide
CID 64612243
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
N-(3-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 60928576
N-[3-(azepan-1-yl)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119892181
N-[3-(azepan-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 120704662

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide (CID 64616785) is 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide is O=C(CC1CNC1)Nc1cccc(N2CCCC2)c1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is HCLGMTXUYGWVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c19-15(8-12-10-16-11-12)17-13-4-3-5-14(9-13)18-6-1-2-7-18/h3-5,9,12,16H,1-2,6-8,10-11H2,(H,17,19).
What are the key properties of 2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 259.35 g/mol, XLogP of 1.83, 4 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-(3-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 64616785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).