N-(2,6-dibromophenyl)morpholine-3-carboxamide

C11H12Br2N2O2 — CID 107599564

IUPACN-(2,6-dibromophenyl)morpholine-3-carboxamide
SMILESO=C(Nc1c(Br)cccc1Br)C1COCCN1
InChIInChI=1S/C11H12Br2N2O2/c12-7-2-1-3-8(13)10(7)15-11(16)9-6-17-5-4-14-9/h1-3,9,14H,4-6H2,(H,15,16)
InChIKeyFXHLCLHPUMKSOX-UHFFFAOYSA-N
MW364.04 g/mol
LogP2.14
Rot. Bonds2

About N-(2,6-dibromophenyl)morpholine-3-carboxamide

N-(2,6-dibromophenyl)morpholine-3-carboxamide (PubChem CID 107599564) has the molecular formula C11H12Br2N2O2 and a molecular weight of 364.04 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)morpholine-3-carboxamide
PubChem CID107599564
Molecular FormulaC11H12Br2N2O2
Molecular Weight364.04 g/mol
Exact Mass361.93
IUPAC NameN-(2,6-dibromophenyl)morpholine-3-carboxamide
SMILESO=C(Nc1c(Br)cccc1Br)C1COCCN1
InChIInChI=1S/C11H12Br2N2O2/c12-7-2-1-3-8(13)10(7)15-11(16)9-6-17-5-4-14-9/h1-3,9,14H,4-6H2,(H,15,16)
InChIKeyFXHLCLHPUMKSOX-UHFFFAOYSA-N
XLogP2.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.04
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-bromo-3-pyridinyl)morpholine-3-carboxamide
CID 103813891
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
(3S)-N-(2-hydroxyphenyl)morpholine-3-carboxamide
CID 96998659
N-(5-bromothiophen-2-yl)morpholine-3-carboxamide
CID 115177539
N-(2-bromo-5-methylphenyl)morpholine-3-carboxamide
CID 82757225
N-(2-fluoro-6-nitrophenyl)morpholine-3-carboxamide
CID 81309920
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(3-carbamoylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119687667
N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide
CID 129248527
3,5-dichloro-4-(morpholine-3-carbonylamino)benzoic acid
CID 82831092
(3S)-N-[3-(trifluoromethyl)phenyl]morpholine-3-carboxamide
CID 129372263
N-[3-(morpholine-4-carbonyl)phenyl]morpholine-3-carboxamide
CID 119712313

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)morpholine-3-carboxamide?
The IUPAC name of N-(2,6-dibromophenyl)morpholine-3-carboxamide (CID 107599564) is N-(2,6-dibromophenyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(2,6-dibromophenyl)morpholine-3-carboxamide?
The canonical SMILES for N-(2,6-dibromophenyl)morpholine-3-carboxamide is O=C(Nc1c(Br)cccc1Br)C1COCCN1.
What is the InChIKey of N-(2,6-dibromophenyl)morpholine-3-carboxamide?
The InChIKey is FXHLCLHPUMKSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br2N2O2/c12-7-2-1-3-8(13)10(7)15-11(16)9-6-17-5-4-14-9/h1-3,9,14H,4-6H2,(H,15,16).
What are the key properties of N-(2,6-dibromophenyl)morpholine-3-carboxamide?
N-(2,6-dibromophenyl)morpholine-3-carboxamide has a molecular weight of 364.04 g/mol, XLogP of 2.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)morpholine-3-carboxamide is sourced from PubChem (CID 107599564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).