4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide

C15H17N3O2 — CID 103174395

IUPAC4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
SMILESCCc1nc(C)ccc1Oc1cc(C(N)=O)ccc1N
InChIInChI=1S/C15H17N3O2/c1-3-12-13(7-4-9(2)18-12)20-14-8-10(15(17)19)5-6-11(14)16/h4-8H,3,16H2,1-2H3,(H2,17,19)
InChIKeyAELOBWUPPZWZIF-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.43
Rot. Bonds4

About 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide

4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide (PubChem CID 103174395) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide.

Molecular Properties

Compound Name4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
PubChem CID103174395
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
SMILESCCc1nc(C)ccc1Oc1cc(C(N)=O)ccc1N
InChIInChI=1S/C15H17N3O2/c1-3-12-13(7-4-9(2)18-12)20-14-8-10(15(17)19)5-6-11(14)16/h4-8H,3,16H2,1-2H3,(H2,17,19)
InChIKeyAELOBWUPPZWZIF-UHFFFAOYSA-N
XLogP2.43
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-5-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
CID 103175349
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-6-methylpyridine-3-carboxylic acid
CID 103174497
4-amino-3-(4-chloro-2-methylphenoxy)benzamide
CID 55188748
4-(2-amino-5-fluorophenoxy)-3-methoxybenzamide
CID 62376981
4-amino-3-propoxybenzamide
CID 63356295
3-amino-4-ethylbenzamide
CID 19977641
4-amino-3-trimethylsilyloxybenzamide
CID 167720584
4-ethoxy-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3,5-triazin-2-amine
CID 103176391
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidin-4-amine
CID 103176295
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-(trifluoromethyl)aniline
CID 103174413
4-amino-3-(4-bromo-2-fluorophenoxy)benzamide
CID 63356585
methyl 3-amino-2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzoate
CID 103175372

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide?
The IUPAC name of 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide (CID 103174395) is 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide.
What is the SMILES notation for 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide?
The canonical SMILES for 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide is CCc1nc(C)ccc1Oc1cc(C(N)=O)ccc1N.
What is the InChIKey of 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide?
The InChIKey is AELOBWUPPZWZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-3-12-13(7-4-9(2)18-12)20-14-8-10(15(17)19)5-6-11(14)16/h4-8H,3,16H2,1-2H3,(H2,17,19).
What are the key properties of 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide?
4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide has a molecular weight of 271.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide is sourced from PubChem (CID 103174395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).