N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide

C20H20N2O3 — CID 110900182

IUPACN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCC(O)CC1)c1cc2ccccc2o1
InChIInChI=1S/C20H20N2O3/c23-15-9-11-22(12-10-15)17-7-3-2-6-16(17)21-20(24)19-13-14-5-1-4-8-18(14)25-19/h1-8,13,15,23H,9-12H2,(H,21,24)
InChIKeyACLMAUHCMWQKHY-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.65
Rot. Bonds3

About N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide

N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide (PubChem CID 110900182) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
PubChem CID110900182
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCC(O)CC1)c1cc2ccccc2o1
InChIInChI=1S/C20H20N2O3/c23-15-9-11-22(12-10-15)17-7-3-2-6-16(17)21-20(24)19-13-14-5-1-4-8-18(14)25-19/h1-8,13,15,23H,9-12H2,(H,21,24)
InChIKeyACLMAUHCMWQKHY-UHFFFAOYSA-N
XLogP3.65
TPSA65.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-amino-2-morpholin-4-ylphenyl)-1-benzofuran-2-carboxamide
CID 28692731
N-(5-chloro-2-piperidin-1-ylphenyl)-1-benzofuran-2-carboxamide
CID 7922537
N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzofuran-2-carboxamide
CID 2670112
2-fluoro-N-[2-(4-hydroxypiperidin-1-yl)phenyl]benzamide
CID 110900198
N-[5-amino-2-(2-methylpiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
CID 91675417
N-[2-(cyclopentylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 17442222
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 110932033
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-4,5-dimethylthiophene-2-carboxamide
CID 110900176
5-fluoro-N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-iodobenzamide
CID 86877934
N-(2-phenylphenyl)-1-benzofuran-2-carboxamide
CID 2473887
methyl 3-(1-benzofuran-2-carbonylamino)-4-(4-ethylpiperazin-1-yl)benzoate
CID 7328887
N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-1-benzofuran-2-carboxamide
CID 26880925

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide (CID 110900182) is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide is O=C(Nc1ccccc1N1CCC(O)CC1)c1cc2ccccc2o1.
What is the InChIKey of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide?
The InChIKey is ACLMAUHCMWQKHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c23-15-9-11-22(12-10-15)17-7-3-2-6-16(17)21-20(24)19-13-14-5-1-4-8-18(14)25-19/h1-8,13,15,23H,9-12H2,(H,21,24).
What are the key properties of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide?
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide has a molecular weight of 336.39 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 110900182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).