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

C16H15N5O3 — CID 647163

IUPACN-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide
SMILESCOc1ccccc1NC(=O)COc1cccc(-n2cnnn2)c1
InChIInChI=1S/C16H15N5O3/c1-23-15-8-3-2-7-14(15)18-16(22)10-24-13-6-4-5-12(9-13)21-11-17-19-20-21/h2-9,11H,10H2,1H3,(H,18,22)
InChIKeySICGIPLRYIVFSJ-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.69
Rot. Bonds6

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

N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide (PubChem CID 647163) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide
PubChem CID647163
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC NameN-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide
SMILESCOc1ccccc1NC(=O)COc1cccc(-n2cnnn2)c1
InChIInChI=1S/C16H15N5O3/c1-23-15-8-3-2-7-14(15)18-16(22)10-24-13-6-4-5-12(9-13)21-11-17-19-20-21/h2-9,11H,10H2,1H3,(H,18,22)
InChIKeySICGIPLRYIVFSJ-UHFFFAOYSA-N
XLogP1.69
TPSA91.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide (CID 647163) is N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide is COc1ccccc1NC(=O)COc1cccc(-n2cnnn2)c1.
What is the InChIKey of N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The InChIKey is SICGIPLRYIVFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-23-15-8-3-2-7-14(15)18-16(22)10-24-13-6-4-5-12(9-13)21-11-17-19-20-21/h2-9,11H,10H2,1H3,(H,18,22).
What are the key properties of N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide has a molecular weight of 325.33 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide is sourced from PubChem (CID 647163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).