N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride

C12H15BrClFN2O2 — CID 119706261

IUPACN-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CNCCO1)Nc1ccc(Br)c(F)c1
InChIInChI=1S/C12H14BrFN2O2.ClH/c13-10-2-1-8(5-11(10)14)16-12(17)6-9-7-15-3-4-18-9;/h1-2,5,9,15H,3-4,6-7H2,(H,16,17);1H
InChIKeyLFPQLDJUTPPGBJ-UHFFFAOYSA-N
MW353.62 g/mol
LogP2.33
Rot. Bonds3

About N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride

N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride (PubChem CID 119706261) has the molecular formula C12H15BrClFN2O2 and a molecular weight of 353.62 g/mol. Its IUPAC name is N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride
PubChem CID119706261
Molecular FormulaC12H15BrClFN2O2
Molecular Weight353.62 g/mol
Exact Mass352.00
IUPAC NameN-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CNCCO1)Nc1ccc(Br)c(F)c1
InChIInChI=1S/C12H14BrFN2O2.ClH/c13-10-2-1-8(5-11(10)14)16-12(17)6-9-7-15-3-4-18-9;/h1-2,5,9,15H,3-4,6-7H2,(H,16,17);1H
InChIKeyLFPQLDJUTPPGBJ-UHFFFAOYSA-N
XLogP2.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.62
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-bromo-3-(trifluoromethyl)phenyl]-2-morpholin-2-ylacetamide
CID 66434951
N-(3-bromo-4-methylphenyl)-2-morpholin-2-ylacetamide
CID 66427265
N-(2-bromo-5-fluorophenyl)-2-morpholin-2-ylacetamide
CID 103808527
N-(3-cyano-4-fluorophenyl)-2-morpholin-2-ylacetamide
CID 66427683
N-(3,5-difluorophenyl)-2-morpholin-2-ylacetamide
CID 66433764
N-(3-iodo-4-methylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119680387
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119669231
N-(3,4-dichlorophenyl)-2-morpholin-2-ylacetamide
CID 66435697
2-morpholin-2-yl-N-phenylacetamide;hydrochloride
CID 119670265
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-morpholin-2-ylacetamide
CID 66435503
N-[4-(2-hydroxyethyl)phenyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 111470973
2-methyl-N-[4-[(2-morpholin-2-ylacetyl)amino]phenyl]propanamide;hydrochloride
CID 119685269

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride (CID 119706261) is N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride is Cl.O=C(CC1CNCCO1)Nc1ccc(Br)c(F)c1.
What is the InChIKey of N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride?
The InChIKey is LFPQLDJUTPPGBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrFN2O2.ClH/c13-10-2-1-8(5-11(10)14)16-12(17)6-9-7-15-3-4-18-9;/h1-2,5,9,15H,3-4,6-7H2,(H,16,17);1H.
What are the key properties of N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride?
N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride has a molecular weight of 353.62 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-fluorophenyl)-2-morpholin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119706261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).