5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide

C15H14N2O4 — CID 174431049

IUPAC5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(Oc2ccccc2C2OCCO2)cn1
InChIInChI=1S/C15H14N2O4/c16-14(18)12-6-5-10(9-17-12)21-13-4-2-1-3-11(13)15-19-7-8-20-15/h1-6,9,15H,7-8H2,(H2,16,18)
InChIKeyOSJCCPVTDIJHKU-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.02
Rot. Bonds4

About 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide

5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide (PubChem CID 174431049) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide
PubChem CID174431049
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(Oc2ccccc2C2OCCO2)cn1
InChIInChI=1S/C15H14N2O4/c16-14(18)12-6-5-10(9-17-12)21-13-4-2-1-3-11(13)15-19-7-8-20-15/h1-6,9,15H,7-8H2,(H2,16,18)
InChIKeyOSJCCPVTDIJHKU-UHFFFAOYSA-N
XLogP2.02
TPSA83.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide?
The IUPAC name of 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide (CID 174431049) is 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide?
The canonical SMILES for 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide is NC(=O)c1ccc(Oc2ccccc2C2OCCO2)cn1.
What is the InChIKey of 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide?
The InChIKey is OSJCCPVTDIJHKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c16-14(18)12-6-5-10(9-17-12)21-13-4-2-1-3-11(13)15-19-7-8-20-15/h1-6,9,15H,7-8H2,(H2,16,18).
What are the key properties of 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide?
5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide has a molecular weight of 286.29 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1,3-dioxolan-2-yl)phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 174431049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).