2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide

C16H14FN5O2 — CID 166398897

IUPAC2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide
SMILESCOc1c(F)cccc1CC(=O)Nc1ccccc1-n1cnnn1
InChIInChI=1S/C16H14FN5O2/c1-24-16-11(5-4-6-12(16)17)9-15(23)19-13-7-2-3-8-14(13)22-10-18-20-21-22/h2-8,10H,9H2,1H3,(H,19,23)
InChIKeyMHJMHDQYDVHMQM-UHFFFAOYSA-N
MW327.32 g/mol
LogP1.99
Rot. Bonds5

About 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide

2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 166398897) has the molecular formula C16H14FN5O2 and a molecular weight of 327.32 g/mol. Its IUPAC name is 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide
PubChem CID166398897
Molecular FormulaC16H14FN5O2
Molecular Weight327.32 g/mol
Exact Mass327.11
IUPAC Name2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide
SMILESCOc1c(F)cccc1CC(=O)Nc1ccccc1-n1cnnn1
InChIInChI=1S/C16H14FN5O2/c1-24-16-11(5-4-6-12(16)17)9-15(23)19-13-7-2-3-8-14(13)22-10-18-20-21-22/h2-8,10H,9H2,1H3,(H,19,23)
InChIKeyMHJMHDQYDVHMQM-UHFFFAOYSA-N
XLogP1.99
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.32
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide (CID 166398897) is 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide is COc1c(F)cccc1CC(=O)Nc1ccccc1-n1cnnn1.
What is the InChIKey of 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is MHJMHDQYDVHMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN5O2/c1-24-16-11(5-4-6-12(16)17)9-15(23)19-13-7-2-3-8-14(13)22-10-18-20-21-22/h2-8,10H,9H2,1H3,(H,19,23).
What are the key properties of 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide?
2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 327.32 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-2-methoxyphenyl)-N-[2-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 166398897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).