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

C15H13N5O2 — CID 856182

IUPACN-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
SMILESO=C(COc1cccc(-n2cnnn2)c1)Nc1ccccc1
InChIInChI=1S/C15H13N5O2/c21-15(17-12-5-2-1-3-6-12)10-22-14-8-4-7-13(9-14)20-11-16-18-19-20/h1-9,11H,10H2,(H,17,21)
InChIKeyHURKKPSRCVCWTB-UHFFFAOYSA-N
MW295.30 g/mol
LogP1.68
Rot. Bonds5

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

N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide (PubChem CID 856182) has the molecular formula C15H13N5O2 and a molecular weight of 295.30 g/mol. Its IUPAC name is N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
PubChem CID856182
Molecular FormulaC15H13N5O2
Molecular Weight295.30 g/mol
Exact Mass295.11
IUPAC NameN-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
SMILESO=C(COc1cccc(-n2cnnn2)c1)Nc1ccccc1
InChIInChI=1S/C15H13N5O2/c21-15(17-12-5-2-1-3-6-12)10-22-14-8-4-7-13(9-14)20-11-16-18-19-20/h1-9,11H,10H2,(H,17,21)
InChIKeyHURKKPSRCVCWTB-UHFFFAOYSA-N
XLogP1.68
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-Chloro-phenyl)-2-(4-tetrazol-1-yl-phenoxy)-acetamide
CID 1080270
N-(2-Ethyl-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 864036
N-(3-methoxyphenyl)-2-[3-(1H-tetraazol-1-yl)phenoxy]acetamide
CID 1140121
N-(3-chloro-4-fluorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 2519672
N-(4-Nitro-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 3165713
N-(2-Methoxy-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 647163
N-(2-Ethoxy-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 654404
N-(4-Ethyl-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 864037
N-(4-Methoxy-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 1140123
2-[4-(Tetrazol-1-yl)phenoxy]acetamide
CID 817506
3-methoxy-4-(1H-1,2,3,4-tetrazol-1-yl)aniline
CID 778173
Methyl 2-[3-(tetrazol-1-yl)phenoxy]acetate
CID 653890

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The IUPAC name of N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide (CID 856182) is N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide.
What is the SMILES notation for N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The canonical SMILES for N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide is O=C(COc1cccc(-n2cnnn2)c1)Nc1ccccc1.
What is the InChIKey of N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
The InChIKey is HURKKPSRCVCWTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O2/c21-15(17-12-5-2-1-3-6-12)10-22-14-8-4-7-13(9-14)20-11-16-18-19-20/h1-9,11H,10H2,(H,17,21).
What are the key properties of N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide?
N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide has a molecular weight of 295.30 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide is sourced from PubChem (CID 856182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).