3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide

C14H15N3O3 — CID 103566450

IUPAC3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide
SMILESCOc1cc(Oc2nccc(C)c2N)cc(C(N)=O)c1
InChIInChI=1S/C14H15N3O3/c1-8-3-4-17-14(12(8)15)20-11-6-9(13(16)18)5-10(7-11)19-2/h3-7H,15H2,1-2H3,(H2,16,18)
InChIKeyZVHPYDOEGHZISH-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.87
Rot. Bonds4

About 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide

3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide (PubChem CID 103566450) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide.

Molecular Properties

Compound Name3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide
PubChem CID103566450
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide
SMILESCOc1cc(Oc2nccc(C)c2N)cc(C(N)=O)c1
InChIInChI=1S/C14H15N3O3/c1-8-3-4-17-14(12(8)15)20-11-6-9(13(16)18)5-10(7-11)19-2/h3-7H,15H2,1-2H3,(H2,16,18)
InChIKeyZVHPYDOEGHZISH-UHFFFAOYSA-N
XLogP1.87
TPSA100.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide?
The IUPAC name of 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide (CID 103566450) is 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide.
What is the SMILES notation for 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide?
The canonical SMILES for 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide is COc1cc(Oc2nccc(C)c2N)cc(C(N)=O)c1.
What is the InChIKey of 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide?
The InChIKey is ZVHPYDOEGHZISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-8-3-4-17-14(12(8)15)20-11-6-9(13(16)18)5-10(7-11)19-2/h3-7H,15H2,1-2H3,(H2,16,18).
What are the key properties of 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide?
3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide has a molecular weight of 273.29 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-amino-4-methyl-2-pyridinyl)oxy]-5-methoxybenzamide is sourced from PubChem (CID 103566450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).