2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide

C15H24BrN3O2 — CID 47041999

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide
SMILESCC(C)CC(CN(C)C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C15H24BrN3O2/c1-11(2)7-13(9-18(3)4)17-14(20)10-19-8-12(16)5-6-15(19)21/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,17,20)
InChIKeyZFMKMXCTNHYVOY-UHFFFAOYSA-N
MW358.28 g/mol
LogP1.70
Rot. Bonds7

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide (PubChem CID 47041999) has the molecular formula C15H24BrN3O2 and a molecular weight of 358.28 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide
PubChem CID47041999
Molecular FormulaC15H24BrN3O2
Molecular Weight358.28 g/mol
Exact Mass357.11
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide
SMILESCC(C)CC(CN(C)C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C15H24BrN3O2/c1-11(2)7-13(9-18(3)4)17-14(20)10-19-8-12(16)5-6-15(19)21/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,17,20)
InChIKeyZFMKMXCTNHYVOY-UHFFFAOYSA-N
XLogP1.70
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.28
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide (CID 47041999) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide is CC(C)CC(CN(C)C)NC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide?
The InChIKey is ZFMKMXCTNHYVOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24BrN3O2/c1-11(2)7-13(9-18(3)4)17-14(20)10-19-8-12(16)5-6-15(19)21/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,17,20).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide has a molecular weight of 358.28 g/mol, XLogP of 1.70, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide is sourced from PubChem (CID 47041999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).