2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide

C21H16FN5O2 — CID 73052519

IUPAC2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide
SMILESNC(=O)COc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C21H16FN5O2/c22-17-10-4-5-11-18(17)27-21(24-25-26-27)16-9-2-1-7-14(16)15-8-3-6-12-19(15)29-13-20(23)28/h1-12H,13H2,(H2,23,28)
InChIKeyKQRBLPBFLYGUAW-UHFFFAOYSA-N
MW389.39 g/mol
LogP3.00
Rot. Bonds6

About 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide

2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide (PubChem CID 73052519) has the molecular formula C21H16FN5O2 and a molecular weight of 389.39 g/mol. Its IUPAC name is 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide
PubChem CID73052519
Molecular FormulaC21H16FN5O2
Molecular Weight389.39 g/mol
Exact Mass389.13
IUPAC Name2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide
SMILESNC(=O)COc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C21H16FN5O2/c22-17-10-4-5-11-18(17)27-21(24-25-26-27)16-9-2-1-7-14(16)15-8-3-6-12-19(15)29-13-20(23)28/h1-12H,13H2,(H2,23,28)
InChIKeyKQRBLPBFLYGUAW-UHFFFAOYSA-N
XLogP3.00
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-((2'-(1-(2-Fluorophenyl)-1h-tetrazol-5-yl)-[1,1'-biphenyl]-2-yl)oxy)acetonitril
CID 72706755
Process for preparing 1-[2-(difluoromethoxy)phenyl]-5-[2-(2-methoxyphenyl)phenyl]-1h-1,2,3,4-tetrazole
CID 73052360
Process for preparing 2-(5-{2-[2-(difluoromethoxy)phenyl]phenyl}-1h-1,2,3,4-tetrazol-1-yl)benzonitrile
CID 73052677
Methyl 2-(2-{2-[1-(2-fluorophenyl)-1H-1,2,3,4-tetrazol-5-yl]phenyl}phenoxy)acetate
CID 73052678
1-(2-Fluorophenyl)-5-[2-(2-methoxyphenyl)phenyl]-1H-1,2,3,4-tetrazole
CID 73052680
Process for preparing 5-{2-[2-(fluoromethoxy)phenyl]phenyl}-1-(2-fluorophenyl)-1h-1,2,3,4-tetrazole
CID 73052681
Process for preparing 5-[2-(2-fluorophenyl)phenyl]-1-(2-methoxyphenyl)-1h-1,2,3,4-tetrazole
CID 73052839
1-(2-Fluorophenyl)-5-{2-[2-(methoxymethoxy)phenyl]phenyl}-1H-1,2,3,4-tetrazole
CID 73052998
1-(2-Fluorophenyl)-5-{2-[2-(propan-2-yloxy)phenyl]phenyl}-1H-1,2,3,4-tetrazole
CID 73052999
5-{2-[2-(Cyclopropylmethoxy)phenyl]phenyl}-1-(2-fluorophenyl)-1H-1,2,3,4-tetrazole
CID 73053141
5-[2-(2-Ethoxyphenyl)phenyl]-1-(2-fluorophenyl)-1H-1,2,3,4-tetrazole
CID 73053143
5-[2-[2-(Difluoromethoxy)phenyl]phenyl]-1-(2-fluorophenyl)tetrazole
CID 73053144

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide?
The IUPAC name of 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide (CID 73052519) is 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide is NC(=O)COc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F.
What is the InChIKey of 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide?
The InChIKey is KQRBLPBFLYGUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN5O2/c22-17-10-4-5-11-18(17)27-21(24-25-26-27)16-9-2-1-7-14(16)15-8-3-6-12-19(15)29-13-20(23)28/h1-12H,13H2,(H2,23,28).
What are the key properties of 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide?
2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide has a molecular weight of 389.39 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenoxy]acetamide is sourced from PubChem (CID 73052519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).