2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide

C21H22N2O3 — CID 172665316

IUPAC2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1ccc2cc(-c3ccc(=O)n(C)c3)ccc2c1
InChIInChI=1S/C21H22N2O3/c1-14(2)22-20(24)13-26-19-8-6-15-10-16(4-5-17(15)11-19)18-7-9-21(25)23(3)12-18/h4-12,14H,13H2,1-3H3,(H,22,24)
InChIKeyCCJFJJJVUPIDEP-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.11
Rot. Bonds5

About 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide

2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide (PubChem CID 172665316) has the molecular formula C21H22N2O3 and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide
PubChem CID172665316
Molecular FormulaC21H22N2O3
Molecular Weight350.42 g/mol
Exact Mass350.16
IUPAC Name2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1ccc2cc(-c3ccc(=O)n(C)c3)ccc2c1
InChIInChI=1S/C21H22N2O3/c1-14(2)22-20(24)13-26-19-8-6-15-10-16(4-5-17(15)11-19)18-7-9-21(25)23(3)12-18/h4-12,14H,13H2,1-3H3,(H,22,24)
InChIKeyCCJFJJJVUPIDEP-UHFFFAOYSA-N
XLogP3.11
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-naphthalen-2-yloxyacetyl)amino]-N-propan-2-ylacetamide
CID 17479065
2-(4-chloro-3-ethylphenoxy)-N-propan-2-ylacetamide
CID 84602074
N-[(2R)-3-methylbutan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 26218455
2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
CID 4149029
2-phenoxy-N-propan-2-ylacetamide
CID 3614481
2-(3-fluorophenoxy)-N-propan-2-ylacetamide
CID 60626005
2-[4-(3-methyl-4-oxophthalazin-1-yl)phenoxy]-N-propan-2-ylacetamide
CID 2025937
2-[(3-oxo-1-benzofuran-6-yl)oxy]-N-propan-2-ylacetamide
CID 60772248
2-[4-(3-methylbutoxy)phenoxy]-N-propan-2-ylacetamide
CID 4732908
2-naphthalen-2-yloxy-N-pentan-3-ylacetamide
CID 24951700
2-naphthalen-2-yloxy-N-[2-[(2-naphthalen-2-yloxyacetyl)amino]propyl]acetamide
CID 3635526
N-[1-(4-methylphenoxy)propan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 132652959

Frequently Asked Questions

What is the IUPAC name of 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide?
The IUPAC name of 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide (CID 172665316) is 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide?
The canonical SMILES for 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide is CC(C)NC(=O)COc1ccc2cc(-c3ccc(=O)n(C)c3)ccc2c1.
What is the InChIKey of 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide?
The InChIKey is CCJFJJJVUPIDEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3/c1-14(2)22-20(24)13-26-19-8-6-15-10-16(4-5-17(15)11-19)18-7-9-21(25)23(3)12-18/h4-12,14H,13H2,1-3H3,(H,22,24).
What are the key properties of 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide?
2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide has a molecular weight of 350.42 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(1-methyl-6-oxo-3-pyridinyl)naphthalen-2-yl]oxy-N-propan-2-ylacetamide is sourced from PubChem (CID 172665316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).