2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide

C23H21N5O2 — CID 7465690

IUPAC2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCc1ccc(-c2nnn(CC(=O)Nc3ccc(OCc4ccccc4)cc3)n2)cc1
InChIInChI=1S/C23H21N5O2/c1-17-7-9-19(10-8-17)23-25-27-28(26-23)15-22(29)24-20-11-13-21(14-12-20)30-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3,(H,24,29)
InChIKeyZHAIUYMZQPCVRZ-UHFFFAOYSA-N
MW399.45 g/mol
LogP3.87
Rot. Bonds7

About 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide

2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 7465690) has the molecular formula C23H21N5O2 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID7465690
Molecular FormulaC23H21N5O2
Molecular Weight399.45 g/mol
Exact Mass399.17
IUPAC Name2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCc1ccc(-c2nnn(CC(=O)Nc3ccc(OCc4ccccc4)cc3)n2)cc1
InChIInChI=1S/C23H21N5O2/c1-17-7-9-19(10-8-17)23-25-27-28(26-23)15-22(29)24-20-11-13-21(14-12-20)30-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3,(H,24,29)
InChIKeyZHAIUYMZQPCVRZ-UHFFFAOYSA-N
XLogP3.87
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(phenoxymethyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide
CID 8868304
N-(4-phenoxyphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634205
2-[5-(4-phenylmethoxyphenyl)tetrazol-2-yl]acetate
CID 7200380
ethyl 4-[[2-[5-(4-methylphenyl)tetrazol-2-yl]acetyl]amino]benzoate
CID 1266768
2-(5-phenyltetrazol-2-yl)-N-(4-pyrimidin-2-yloxyphenyl)acetamide
CID 55921125
2-[5-[4-(dimethylamino)phenyl]tetrazol-2-yl]-N-(4-ethoxyphenyl)acetamide
CID 1146774
2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]-N-(4-methylphenyl)acetamide
CID 1164686
2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
CID 24564895
N-(4-tert-butylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508157
3-(4-methylphenoxy)-N-(4-phenylmethoxyphenyl)propanamide
CID 7963977
N-(3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 856053
N-(3,4-dimethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16561616

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide (CID 7465690) is 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide is Cc1ccc(-c2nnn(CC(=O)Nc3ccc(OCc4ccccc4)cc3)n2)cc1.
What is the InChIKey of 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is ZHAIUYMZQPCVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2/c1-17-7-9-19(10-8-17)23-25-27-28(26-23)15-22(29)24-20-11-13-21(14-12-20)30-16-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3,(H,24,29).
What are the key properties of 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide?
2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 399.45 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 7465690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).