2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide

C16H13F2N5O2 — CID 67672151

IUPAC2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide
SMILESCN(C(=O)COn1nnc(-c2c(F)cccc2F)n1)c1ccccc1
InChIInChI=1S/C16H13F2N5O2/c1-22(11-6-3-2-4-7-11)14(24)10-25-23-20-16(19-21-23)15-12(17)8-5-9-13(15)18/h2-9H,10H2,1H3
InChIKeyZHJHNTWZLJZXPN-UHFFFAOYSA-N
MW345.31 g/mol
LogP1.71
Rot. Bonds5

About 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide

2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide (PubChem CID 67672151) has the molecular formula C16H13F2N5O2 and a molecular weight of 345.31 g/mol. Its IUPAC name is 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide
PubChem CID67672151
Molecular FormulaC16H13F2N5O2
Molecular Weight345.31 g/mol
Exact Mass345.10
IUPAC Name2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide
SMILESCN(C(=O)COn1nnc(-c2c(F)cccc2F)n1)c1ccccc1
InChIInChI=1S/C16H13F2N5O2/c1-22(11-6-3-2-4-7-11)14(24)10-25-23-20-16(19-21-23)15-12(17)8-5-9-13(15)18/h2-9H,10H2,1H3
InChIKeyZHJHNTWZLJZXPN-UHFFFAOYSA-N
XLogP1.71
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.31
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[5-(2,6-difluorophenyl)-1,3,4-thiadiazol-2-yl]oxy]-N-methyl-N-phenylacetamide
CID 15405414
5-(2,6-difluorophenyl)-2-ethyltetrazole
CID 143805433
N-methyl-N-(4-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 166719133
2-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-N-phenylacetamide
CID 86165736
N-(2-fluorophenyl)-N-methyl-2-(5-phenyltetrazol-2-yl)acetamide
CID 177372539
2-[5-(3-methoxyphenyl)tetrazol-2-yl]-N-methyl-N-phenylacetamide
CID 26676736
2-(3-fluorophenoxy)-N-methyl-N-phenylacetamide
CID 78762284
N-methyl-N-phenyl-2-pyrimidin-2-yloxyacetamide
CID 121086783
[2-(N-methylanilino)-2-oxoethyl] (E)-3-(2-fluorophenyl)prop-2-enoate
CID 2613142
[2-(N-methylanilino)-2-oxoethyl] 3-methylbenzoate
CID 46860545
3-[5-(2,6-difluorophenyl)-1,3-oxazol-2-yl]-N-methyl-N-phenylpropanamide
CID 29494121
2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-methyl-N-phenylacetamide
CID 4810015

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide (CID 67672151) is 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide is CN(C(=O)COn1nnc(-c2c(F)cccc2F)n1)c1ccccc1.
What is the InChIKey of 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide?
The InChIKey is ZHJHNTWZLJZXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N5O2/c1-22(11-6-3-2-4-7-11)14(24)10-25-23-20-16(19-21-23)15-12(17)8-5-9-13(15)18/h2-9H,10H2,1H3.
What are the key properties of 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide?
2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide has a molecular weight of 345.31 g/mol, XLogP of 1.71, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2,6-difluorophenyl)tetrazol-2-yl]oxy-N-methyl-N-phenylacetamide is sourced from PubChem (CID 67672151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).