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

C14H14N2O3 — CID 107709658

IUPAC4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(Oc2ccc(CCO)cc2)ccn1
InChIInChI=1S/C14H14N2O3/c15-14(18)13-9-12(5-7-16-13)19-11-3-1-10(2-4-11)6-8-17/h1-5,7,9,17H,6,8H2,(H2,15,18)
InChIKeyYVVOAPPSVWEOOM-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.51
Rot. Bonds5

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

4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide (PubChem CID 107709658) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide
PubChem CID107709658
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(Oc2ccc(CCO)cc2)ccn1
InChIInChI=1S/C14H14N2O3/c15-14(18)13-9-12(5-7-16-13)19-11-3-1-10(2-4-11)6-8-17/h1-5,7,9,17H,6,8H2,(H2,15,18)
InChIKeyYVVOAPPSVWEOOM-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 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide?
The IUPAC name of 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide (CID 107709658) is 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide is NC(=O)c1cc(Oc2ccc(CCO)cc2)ccn1.
What is the InChIKey of 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide?
The InChIKey is YVVOAPPSVWEOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c15-14(18)13-9-12(5-7-16-13)19-11-3-1-10(2-4-11)6-8-17/h1-5,7,9,17H,6,8H2,(H2,15,18).
What are the key properties of 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide?
4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-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 4-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 107709658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).