N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide

C17H15N3O3 — CID 75203263

IUPACN-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide
SMILESO=C(NCCO)c1ccc2cncc(-c3cccc(O)c3)c2n1
InChIInChI=1S/C17H15N3O3/c21-7-6-19-17(23)15-5-4-12-9-18-10-14(16(12)20-15)11-2-1-3-13(22)8-11/h1-5,8-10,21-22H,6-7H2,(H,19,23)
InChIKeyIWDXJDXDAXMYGK-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.72
Rot. Bonds4

About N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide

N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide (PubChem CID 75203263) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide
PubChem CID75203263
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide
SMILESO=C(NCCO)c1ccc2cncc(-c3cccc(O)c3)c2n1
InChIInChI=1S/C17H15N3O3/c21-7-6-19-17(23)15-5-4-12-9-18-10-14(16(12)20-15)11-2-1-3-13(22)8-11/h1-5,8-10,21-22H,6-7H2,(H,19,23)
InChIKeyIWDXJDXDAXMYGK-UHFFFAOYSA-N
XLogP1.72
TPSA95.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide (CID 75203263) is N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide is O=C(NCCO)c1ccc2cncc(-c3cccc(O)c3)c2n1.
What is the InChIKey of N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide?
The InChIKey is IWDXJDXDAXMYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c21-7-6-19-17(23)15-5-4-12-9-18-10-14(16(12)20-15)11-2-1-3-13(22)8-11/h1-5,8-10,21-22H,6-7H2,(H,19,23).
What are the key properties of N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide?
N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 1.72, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-8-(3-hydroxyphenyl)-1,6-naphthyridine-2-carboxamide is sourced from PubChem (CID 75203263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).