2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide

C10H12ClN3O — CID 83167857

IUPAC2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide
SMILESO=C(CC1CNC1)Nc1cnccc1Cl
InChIInChI=1S/C10H12ClN3O/c11-8-1-2-12-6-9(8)14-10(15)3-7-4-13-5-7/h1-2,6-7,13H,3-5H2,(H,14,15)
InChIKeyUUUFLJSRHVFJEC-UHFFFAOYSA-N
MW225.68 g/mol
LogP1.28
Rot. Bonds3

About 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide

2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide (PubChem CID 83167857) has the molecular formula C10H12ClN3O and a molecular weight of 225.68 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide
PubChem CID83167857
Molecular FormulaC10H12ClN3O
Molecular Weight225.68 g/mol
Exact Mass225.07
IUPAC Name2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide
SMILESO=C(CC1CNC1)Nc1cnccc1Cl
InChIInChI=1S/C10H12ClN3O/c11-8-1-2-12-6-9(8)14-10(15)3-7-4-13-5-7/h1-2,6-7,13H,3-5H2,(H,14,15)
InChIKeyUUUFLJSRHVFJEC-UHFFFAOYSA-N
XLogP1.28
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide (CID 83167857) is 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide is O=C(CC1CNC1)Nc1cnccc1Cl.
What is the InChIKey of 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide?
The InChIKey is UUUFLJSRHVFJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O/c11-8-1-2-12-6-9(8)14-10(15)3-7-4-13-5-7/h1-2,6-7,13H,3-5H2,(H,14,15).
What are the key properties of 2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide?
2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide has a molecular weight of 225.68 g/mol, XLogP of 1.28, 3 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-(4-chloro-3-pyridinyl)acetamide is sourced from PubChem (CID 83167857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).