2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide

C14H14N2O3 — CID 107709590

IUPAC2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1ccc(CCO)cc1
InChIInChI=1S/C14H14N2O3/c15-13(18)12-2-1-8-16-14(12)19-11-5-3-10(4-6-11)7-9-17/h1-6,8,17H,7,9H2,(H2,15,18)
InChIKeyNGYNCCSEHZDOQZ-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.51
Rot. Bonds5

About 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide

2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide (PubChem CID 107709590) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
PubChem CID107709590
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1ccc(CCO)cc1
InChIInChI=1S/C14H14N2O3/c15-13(18)12-2-1-8-16-14(12)19-11-5-3-10(4-6-11)7-9-17/h1-6,8,17H,7,9H2,(H2,15,18)
InChIKeyNGYNCCSEHZDOQZ-UHFFFAOYSA-N
XLogP1.51
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide (CID 107709590) is 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide is NC(=O)c1cccnc1Oc1ccc(CCO)cc1.
What is the InChIKey of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The InChIKey is NGYNCCSEHZDOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c15-13(18)12-2-1-8-16-14(12)19-11-5-3-10(4-6-11)7-9-17/h1-6,8,17H,7,9H2,(H2,15,18).
What are the key properties of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 107709590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).