5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide

C20H24BrN3O3 — CID 137370573

IUPAC5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1N1CCCCC1)c1ccc(Br)o1
InChIInChI=1S/C20H24BrN3O3/c21-19-7-6-18(27-19)20(25)22-16-5-4-15(23-10-12-26-13-11-23)14-17(16)24-8-2-1-3-9-24/h4-7,14H,1-3,8-13H2,(H,22,25)
InChIKeyTURGOMCZFTWSNW-UHFFFAOYSA-N
MW434.33 g/mol
LogP4.12
Rot. Bonds4

About 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide

5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide (PubChem CID 137370573) has the molecular formula C20H24BrN3O3 and a molecular weight of 434.33 g/mol. Its IUPAC name is 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide
PubChem CID137370573
Molecular FormulaC20H24BrN3O3
Molecular Weight434.33 g/mol
Exact Mass433.10
IUPAC Name5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1N1CCCCC1)c1ccc(Br)o1
InChIInChI=1S/C20H24BrN3O3/c21-19-7-6-18(27-19)20(25)22-16-5-4-15(23-10-12-26-13-11-23)14-17(16)24-8-2-1-3-9-24/h4-7,14H,1-3,8-13H2,(H,22,25)
InChIKeyTURGOMCZFTWSNW-UHFFFAOYSA-N
XLogP4.12
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.33
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-(6-morpholin-4-yl-4-piperidin-1-yl-3-pyridinyl)furan-2-carboxamide;ethane
CID 142511638
5-bromo-N-[4-(morpholin-2-ylmethyl)-2-piperidin-1-ylphenyl]furan-2-carboxamide
CID 175337810
5-bromo-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 1288515
5-bromo-N-(3-chloro-2-morpholin-4-ylphenyl)furan-2-carboxamide
CID 1017993
5-bromo-N-(5-methoxy-2-pyrrolidin-1-ylphenyl)furan-2-carboxamide
CID 6496960
N-(2-methyl-4-morpholin-4-ylphenyl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55632664
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
5-bromo-N-[4-[2-(3-morpholin-4-ylanilino)-2-oxoethyl]phenyl]furan-2-carboxamide
CID 55951161
5-bromo-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]furan-2-carboxamide
CID 16889512
5-bromo-N-(2-morpholin-4-ylpyrimidin-5-yl)furan-2-carboxamide
CID 53164805
N-(2,4-dimorpholin-4-ylphenyl)-3-fluorobenzamide
CID 4824008
5-bromo-N-[5-(morpholin-2-ylmethyl)-2-piperidin-1-ylphenyl]furan-2-carboxamide
CID 175010773

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide (CID 137370573) is 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide is O=C(Nc1ccc(N2CCOCC2)cc1N1CCCCC1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide?
The InChIKey is TURGOMCZFTWSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24BrN3O3/c21-19-7-6-18(27-19)20(25)22-16-5-4-15(23-10-12-26-13-11-23)14-17(16)24-8-2-1-3-9-24/h4-7,14H,1-3,8-13H2,(H,22,25).
What are the key properties of 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide?
5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide has a molecular weight of 434.33 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-morpholin-4-yl-2-piperidin-1-ylphenyl)furan-2-carboxamide is sourced from PubChem (CID 137370573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).