2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide

C11H14BrN3O — CID 83170220

IUPAC2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide
SMILESCc1cc(Br)cnc1NC(=O)CC1CNC1
InChIInChI=1S/C11H14BrN3O/c1-7-2-9(12)6-14-11(7)15-10(16)3-8-4-13-5-8/h2,6,8,13H,3-5H2,1H3,(H,14,15,16)
InChIKeyIXTZIEPQKRFIAA-UHFFFAOYSA-N
MW284.16 g/mol
LogP1.70
Rot. Bonds3

About 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide

2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide (PubChem CID 83170220) has the molecular formula C11H14BrN3O and a molecular weight of 284.16 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide
PubChem CID83170220
Molecular FormulaC11H14BrN3O
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide
SMILESCc1cc(Br)cnc1NC(=O)CC1CNC1
InChIInChI=1S/C11H14BrN3O/c1-7-2-9(12)6-14-11(7)15-10(16)3-8-4-13-5-8/h2,6,8,13H,3-5H2,1H3,(H,14,15,16)
InChIKeyIXTZIEPQKRFIAA-UHFFFAOYSA-N
XLogP1.70
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.16
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734717
2-(azetidin-3-yl)-N-(3-bromo-5-methylphenyl)acetamide
CID 107583496
N-(5-bromo-3-methyl-2-pyridinyl)-3,3,3-trifluoropropanamide
CID 81489506
N-(5-bromo-3-methyl-2-pyridinyl)-2-pyrrolidin-1-ylacetamide
CID 67362705
N-(5-bromo-3-methyl-2-pyridinyl)-2-(1,4-diazepan-1-yl)acetamide
CID 83167352
N-(5-bromo-3-methyl-2-pyridinyl)-2-(2-methylphenyl)acetamide
CID 81489668
N-(5-bromo-3-methyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 81489355
2-(azetidin-3-yl)-N-(5-methyl-2-pyridinyl)acetamide
CID 64617953
N-(5-bromo-4-methyl-2-pyridinyl)-2-pyrrolidin-3-ylacetamide
CID 79733319
4-[(5-bromo-3-methyl-2-pyridinyl)amino]-2,2-diethyl-4-oxobutanoic acid
CID 83166512
N-(5-bromo-3-methyl-2-pyridinyl)-2-(4-carbamothioylphenyl)acetamide
CID 83164553
2-(azetidin-3-yl)-N-(2-bromo-5-methylphenyl)acetamide
CID 82756641

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide (CID 83170220) is 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide is Cc1cc(Br)cnc1NC(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide?
The InChIKey is IXTZIEPQKRFIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O/c1-7-2-9(12)6-14-11(7)15-10(16)3-8-4-13-5-8/h2,6,8,13H,3-5H2,1H3,(H,14,15,16).
What are the key properties of 2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide?
2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide has a molecular weight of 284.16 g/mol, XLogP of 1.70, 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-(5-bromo-3-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 83170220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).