N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride

C11H15BrClN3O3 — CID 119820984

IUPACN-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride
SMILESCl.Cn1cc(NC(=O)C2COCCN2)cc(Br)c1=O
InChIInChI=1S/C11H14BrN3O3.ClH/c1-15-5-7(4-8(12)11(15)17)14-10(16)9-6-18-3-2-13-9;/h4-5,9,13H,2-3,6H2,1H3,(H,14,16);1H
InChIKeyZWBBOXUUCFBGFK-UHFFFAOYSA-N
MW352.62 g/mol
LogP0.50
Rot. Bonds2

About N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride

N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119820984) has the molecular formula C11H15BrClN3O3 and a molecular weight of 352.62 g/mol. Its IUPAC name is N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119820984
Molecular FormulaC11H15BrClN3O3
Molecular Weight352.62 g/mol
Exact Mass351.00
IUPAC NameN-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride
SMILESCl.Cn1cc(NC(=O)C2COCCN2)cc(Br)c1=O
InChIInChI=1S/C11H14BrN3O3.ClH/c1-15-5-7(4-8(12)11(15)17)14-10(16)9-6-18-3-2-13-9;/h4-5,9,13H,2-3,6H2,1H3,(H,14,16);1H
InChIKeyZWBBOXUUCFBGFK-UHFFFAOYSA-N
XLogP0.50
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.62
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119344897
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-(3-fluoro-5-methylphenyl)morpholine-3-carboxamide
CID 79049402
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-(2-bromo-5-methylphenyl)morpholine-3-carboxamide
CID 82757225
N-(2,6-dibromophenyl)morpholine-3-carboxamide
CID 107599564
N-(3,5-difluoro-4-iodophenyl)morpholine-3-carboxamide;hydrochloride
CID 119764589
N-[4-(2-methylpropanoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119685241
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]morpholine-3-carboxamide;hydrochloride
CID 119698805
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(6-bromo-3-pyridinyl)morpholine-3-carboxamide
CID 103813891

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride (CID 119820984) is N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride is Cl.Cn1cc(NC(=O)C2COCCN2)cc(Br)c1=O.
What is the InChIKey of N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is ZWBBOXUUCFBGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O3.ClH/c1-15-5-7(4-8(12)11(15)17)14-10(16)9-6-18-3-2-13-9;/h4-5,9,13H,2-3,6H2,1H3,(H,14,16);1H.
What are the key properties of N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride?
N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 352.62 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119820984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).