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

C20H18N2O2 — CID 155516061

IUPACN-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)cn1
InChIInChI=1S/C20H18N2O2/c23-18-9-6-15(7-10-18)12-13-21-20(24)19-11-8-17(14-22-19)16-4-2-1-3-5-16/h1-11,14,23H,12-13H2,(H,21,24)
InChIKeyBTCDEKNSKINZJW-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.43
Rot. Bonds5

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

N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide (PubChem CID 155516061) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide
PubChem CID155516061
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)cn1
InChIInChI=1S/C20H18N2O2/c23-18-9-6-15(7-10-18)12-13-21-20(24)19-11-8-17(14-22-19)16-4-2-1-3-5-16/h1-11,14,23H,12-13H2,(H,21,24)
InChIKeyBTCDEKNSKINZJW-UHFFFAOYSA-N
XLogP3.43
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.43
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-phenylpyridine-2-carboxamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide (CID 155516061) is N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide is O=C(NCCc1ccc(O)cc1)c1ccc(-c2ccccc2)cn1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide?
The InChIKey is BTCDEKNSKINZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c23-18-9-6-15(7-10-18)12-13-21-20(24)19-11-8-17(14-22-19)16-4-2-1-3-5-16/h1-11,14,23H,12-13H2,(H,21,24).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide?
N-[2-(4-hydroxyphenyl)ethyl]-5-phenylpyridine-2-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 3.43, 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-phenylpyridine-2-carboxamide is sourced from PubChem (CID 155516061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).