5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide

C15H14BrClN2O3 — CID 1017993

IUPAC5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1N1CCOCC1)c1ccc(Br)o1
InChIInChI=1S/C15H14BrClN2O3/c16-13-5-4-12(22-13)15(20)18-11-3-1-2-10(17)14(11)19-6-8-21-9-7-19/h1-5H,6-9H2,(H,18,20)
InChIKeyBWIZAYDZYSWFAD-UHFFFAOYSA-N
MW385.65 g/mol
LogP3.78
Rot. Bonds3

About 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide

5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide (PubChem CID 1017993) has the molecular formula C15H14BrClN2O3 and a molecular weight of 385.65 g/mol. Its IUPAC name is 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide
PubChem CID1017993
Molecular FormulaC15H14BrClN2O3
Molecular Weight385.65 g/mol
Exact Mass383.99
IUPAC Name5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1N1CCOCC1)c1ccc(Br)o1
InChIInChI=1S/C15H14BrClN2O3/c16-13-5-4-12(22-13)15(20)18-11-3-1-2-10(17)14(11)19-6-8-21-9-7-19/h1-5H,6-9H2,(H,18,20)
InChIKeyBWIZAYDZYSWFAD-UHFFFAOYSA-N
XLogP3.78
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.65
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]furan-2-carboxamide
CID 17066185
5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)naphthalene-1-carboxamide
CID 1254482
3,4-dichloro-N-(3-chloro-2-morpholin-4-ylphenyl)benzamide
CID 3478748
2-chloro-N-(3-chloro-2-morpholin-4-ylphenyl)-5-iodobenzamide
CID 3968174
N-(3-chloro-2-morpholin-4-ylphenyl)-2-fluorobenzamide
CID 952438
5-bromo-N-(3-chloro-2-methylphenyl)furan-2-carboxamide
CID 675043
6-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)-3-methyl-1-benzofuran-2-carboxamide
CID 118984847
5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide
CID 137370573
N-(3-chloro-2-morpholin-4-ylphenyl)-2,6-dimethylpyridine-3-carboxamide
CID 131960632
3,5-dichloro-N-(3-chloro-2-morpholin-4-ylphenyl)-4-methoxybenzamide
CID 4029398
N-(3-chloro-2-piperidin-1-ylphenyl)-5-nitrofuran-2-carboxamide
CID 952498
N-[(3-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-5-(3,4-dichlorophenyl)furan-2-carboxamide
CID 17114167

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide (CID 1017993) is 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide is O=C(Nc1cccc(Cl)c1N1CCOCC1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide?
The InChIKey is BWIZAYDZYSWFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O3/c16-13-5-4-12(22-13)15(20)18-11-3-1-2-10(17)14(11)19-6-8-21-9-7-19/h1-5H,6-9H2,(H,18,20).
What are the key properties of 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide?
5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide has a molecular weight of 385.65 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide is sourced from PubChem (CID 1017993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).