5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide

C13H13BrN4O3 — CID 53164805

IUPAC5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)c1ccc(Br)o1
InChIInChI=1S/C13H13BrN4O3/c14-11-2-1-10(21-11)12(19)17-9-7-15-13(16-8-9)18-3-5-20-6-4-18/h1-2,7-8H,3-6H2,(H,17,19)
InChIKeyQTJFHZICBWCELN-UHFFFAOYSA-N
MW353.18 g/mol
LogP1.92
Rot. Bonds3

About 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide

5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide (PubChem CID 53164805) has the molecular formula C13H13BrN4O3 and a molecular weight of 353.18 g/mol. Its IUPAC name is 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide
PubChem CID53164805
Molecular FormulaC13H13BrN4O3
Molecular Weight353.18 g/mol
Exact Mass352.02
IUPAC Name5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)c1ccc(Br)o1
InChIInChI=1S/C13H13BrN4O3/c14-11-2-1-10(21-11)12(19)17-9-7-15-13(16-8-9)18-3-5-20-6-4-18/h1-2,7-8H,3-6H2,(H,17,19)
InChIKeyQTJFHZICBWCELN-UHFFFAOYSA-N
XLogP1.92
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.18
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide
CID 91968599
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
4-iodo-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 122299046
5-bromo-N-[4-(6-morpholin-4-ylpyridazin-3-yl)phenyl]furan-2-carboxamide
CID 18581271
N-(2-morpholin-4-ylpyrimidin-5-yl)-4-(trifluoromethyl)benzamide
CID 53164816
2-iodo-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 122299045
2,5-dimethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164782
4-methoxy-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164846
5-bromo-N-(6-morpholin-4-yl-4-piperidin-1-yl-3-pyridinyl)furan-2-carboxamide;ethane
CID 142511638
2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164826
5-bromo-N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]furan-2-carboxamide
CID 84559000
5-bromo-N-[4-[2-(3-morpholin-4-ylanilino)-2-oxoethyl]phenyl]furan-2-carboxamide
CID 55951161

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide (CID 53164805) is 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide is O=C(Nc1cnc(N2CCOCC2)nc1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide?
The InChIKey is QTJFHZICBWCELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN4O3/c14-11-2-1-10(21-11)12(19)17-9-7-15-13(16-8-9)18-3-5-20-6-4-18/h1-2,7-8H,3-6H2,(H,17,19).
What are the key properties of 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide?
5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide has a molecular weight of 353.18 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide is sourced from PubChem (CID 53164805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).