2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide

C14H12N4O2 — CID 846265

IUPAC2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ncn[nH]1
InChIInChI=1S/C14H12N4O2/c19-13(17-14-15-9-16-18-14)8-20-12-6-5-10-3-1-2-4-11(10)7-12/h1-7,9H,8H2,(H2,15,16,17,18,19)
InChIKeySQNHLCIIYGJLII-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.98
Rot. Bonds4

About 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide

2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide (PubChem CID 846265) has the molecular formula C14H12N4O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide
PubChem CID846265
Molecular FormulaC14H12N4O2
Molecular Weight268.28 g/mol
Exact Mass268.10
IUPAC Name2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ncn[nH]1
InChIInChI=1S/C14H12N4O2/c19-13(17-14-15-9-16-18-14)8-20-12-6-5-10-3-1-2-4-11(10)7-12/h1-7,9H,8H2,(H2,15,16,17,18,19)
InChIKeySQNHLCIIYGJLII-UHFFFAOYSA-N
XLogP1.98
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Phenoxy-N-(4H-[1,2,4]triazol-3-yl)-acetamide
CID 555301
2-(2,6-dimethylphenoxy)-N-(4H-1,2,4-triazol-3-yl)acetamide
CID 650512
2-(4-ethylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 698942
2-(2-Tert-butylphenoxy)-N-(4H-1,2,4-triazol-3-YL)acetamide
CID 719144
2-[(1-bromo-2-naphthyl)oxy]-N-4H-1,2,4-triazol-3-ylacetamide
CID 2215917
2-(2,3-dimethylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 674929
2-(1-bromonaphthalen-2-yl)oxy-N-(1,2,4-triazol-4-yl)acetamide
CID 2216508
2-(3-methylphenoxy)-N-(4H-1,2,4-triazol-3-yl)propanamide
CID 6471361
2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]-N-(4H-1,2,4-triazol-3-yl)acetamide
CID 698947
N-(4H-1,2,4-triazol-3-yl)-2-[4-(methylethyl)phenoxy]acetamide
CID 704245
N-(4H-1,2,4-triazol-3-yl)-2-[4-(1-methyl-1-phenylethyl)phenoxy]acetamide
CID 711965
2-(4-phenylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 719155

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide (CID 846265) is 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide is O=C(COc1ccc2ccccc2c1)Nc1ncn[nH]1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The InChIKey is SQNHLCIIYGJLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c19-13(17-14-15-9-16-18-14)8-20-12-6-5-10-3-1-2-4-11(10)7-12/h1-7,9H,8H2,(H2,15,16,17,18,19).
What are the key properties of 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide has a molecular weight of 268.28 g/mol, XLogP of 1.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-(1H-1,2,4-triazol-5-yl)acetamide is sourced from PubChem (CID 846265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).