N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide

C19H17NO3 — CID 4108306

IUPACN-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H17NO3/c21-16-8-6-14(7-9-16)12-13-20-19(22)18-11-10-17(23-18)15-4-2-1-3-5-15/h1-11,21H,12-13H2,(H,20,22)
InChIKeyXNJSTNYZMRSFBK-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.62
Rot. Bonds5

About N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide

N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide (PubChem CID 4108306) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide
PubChem CID4108306
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H17NO3/c21-16-8-6-14(7-9-16)12-13-20-19(22)18-11-10-17(23-18)15-4-2-1-3-5-15/h1-11,21H,12-13H2,(H,20,22)
InChIKeyXNJSTNYZMRSFBK-UHFFFAOYSA-N
XLogP3.62
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide (CID 4108306) is N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide is O=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)o1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide?
The InChIKey is XNJSTNYZMRSFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c21-16-8-6-14(7-9-16)12-13-20-19(22)18-11-10-17(23-18)15-4-2-1-3-5-15/h1-11,21H,12-13H2,(H,20,22).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide?
N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]-5-phenylfuran-2-carboxamide is sourced from PubChem (CID 4108306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).