3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide

C20H19N3O3 — CID 24821159

IUPAC3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
SMILESNc1ncc(-c2cccc(C(=O)NCCO)c2)cc1-c1ccc(O)cc1
InChIInChI=1S/C20H19N3O3/c21-19-18(13-4-6-17(25)7-5-13)11-16(12-23-19)14-2-1-3-15(10-14)20(26)22-8-9-24/h1-7,10-12,24-25H,8-9H2,(H2,21,23)(H,22,26)
InChIKeyZHOFTYXUAXEAGP-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.43
Rot. Bonds5

About 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide

3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide (PubChem CID 24821159) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
PubChem CID24821159
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
SMILESNc1ncc(-c2cccc(C(=O)NCCO)c2)cc1-c1ccc(O)cc1
InChIInChI=1S/C20H19N3O3/c21-19-18(13-4-6-17(25)7-5-13)11-16(12-23-19)14-2-1-3-15(10-14)20(26)22-8-9-24/h1-7,10-12,24-25H,8-9H2,(H2,21,23)(H,22,26)
InChIKeyZHOFTYXUAXEAGP-UHFFFAOYSA-N
XLogP2.43
TPSA108.47 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

3-[6-amino-5-(3,4,5-trimethoxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
CID 126672906
3-[6-amino-5-(4-phenylphenyl)-3-pyridinyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 25106863
3-[6-amino-5-(3,5-dimethoxyphenyl)-3-pyridinyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 58238273
3-[6-amino-5-(4-chloro-3-fluorophenyl)-3-pyridinyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 25107400
3-[6-amino-5-(3-phenoxyphenyl)-3-pyridinyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 25107397
3-[6-amino-5-(2-methylsulfanylpyrimidin-4-yl)-3-pyridinyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 58238249
3-(5-amino-6-morpholin-4-ylpyrazin-2-yl)-N-(2-hydroxyethyl)benzamide
CID 126475128
[4-[3-(2-hydroxyethylcarbamoyl)phenyl]phenyl] acetate
CID 2274112
N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-3-(4-hydroxyphenyl)benzamide
CID 119071037
3-(3-acetylphenyl)-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 117084824
3-[6-amino-5-(furan-3-yl)-3-pyridinyl]benzamide
CID 25106949
3-(2-amino-5-methyl-3-pyridinyl)-N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]benzamide
CID 169420165

Frequently Asked Questions

What is the IUPAC name of 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide (CID 24821159) is 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide is Nc1ncc(-c2cccc(C(=O)NCCO)c2)cc1-c1ccc(O)cc1.
What is the InChIKey of 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide?
The InChIKey is ZHOFTYXUAXEAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c21-19-18(13-4-6-17(25)7-5-13)11-16(12-23-19)14-2-1-3-15(10-14)20(26)22-8-9-24/h1-7,10-12,24-25H,8-9H2,(H2,21,23)(H,22,26).
What are the key properties of 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide?
3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide has a molecular weight of 349.39 g/mol, XLogP of 2.43, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 24821159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).