N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide

C10H11Br2N3O2 — CID 129248527

IUPACN-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide
SMILESO=C(Nc1ncc(Br)cc1Br)C1COCCN1
InChIInChI=1S/C10H11Br2N3O2/c11-6-3-7(12)9(14-4-6)15-10(16)8-5-17-2-1-13-8/h3-4,8,13H,1-2,5H2,(H,14,15,16)
InChIKeyLTCRKCBHLQBQTM-UHFFFAOYSA-N
MW365.03 g/mol
LogP1.53
Rot. Bonds2

About N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide

N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide (PubChem CID 129248527) has the molecular formula C10H11Br2N3O2 and a molecular weight of 365.03 g/mol. Its IUPAC name is N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide
PubChem CID129248527
Molecular FormulaC10H11Br2N3O2
Molecular Weight365.03 g/mol
Exact Mass362.92
IUPAC NameN-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide
SMILESO=C(Nc1ncc(Br)cc1Br)C1COCCN1
InChIInChI=1S/C10H11Br2N3O2/c11-6-3-7(12)9(14-4-6)15-10(16)8-5-17-2-1-13-8/h3-4,8,13H,1-2,5H2,(H,14,15,16)
InChIKeyLTCRKCBHLQBQTM-UHFFFAOYSA-N
XLogP1.53
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.03
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-bromo-3-pyridinyl)morpholine-3-carboxamide
CID 103813891
N-(2,6-dibromophenyl)morpholine-3-carboxamide
CID 107599564
N-(2-bromo-5-methylphenyl)morpholine-3-carboxamide
CID 82757225
N-(1,3-oxazol-5-yl)morpholine-3-carboxamide
CID 83618356
N-(5-ethyl-1,3-thiazol-2-yl)morpholine-3-carboxamide
CID 119755286
N-(6-chloro-4-methyl-3-pyridinyl)morpholine-3-carboxamide
CID 113266715
N-(5-bromothiophen-2-yl)morpholine-3-carboxamide
CID 115177539
N-(3-fluoro-5-methylphenyl)morpholine-3-carboxamide
CID 79049402
N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)morpholine-3-carboxamide;hydrochloride
CID 119820984
N-(5-propan-2-yl-1H-pyrazol-3-yl)morpholine-3-carboxamide
CID 104618392
N-[6-(trifluoromethyl)-3-pyridinyl]morpholine-3-carboxamide
CID 82817726
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide?
The IUPAC name of N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide (CID 129248527) is N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide?
The canonical SMILES for N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide is O=C(Nc1ncc(Br)cc1Br)C1COCCN1.
What is the InChIKey of N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide?
The InChIKey is LTCRKCBHLQBQTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Br2N3O2/c11-6-3-7(12)9(14-4-6)15-10(16)8-5-17-2-1-13-8/h3-4,8,13H,1-2,5H2,(H,14,15,16).
What are the key properties of N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide?
N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide has a molecular weight of 365.03 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dibromo-2-pyridinyl)morpholine-3-carboxamide is sourced from PubChem (CID 129248527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).