4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide

C20H15N5O2 — CID 26729233

IUPAC4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-n2cnnn2)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C20H15N5O2/c26-20(22-16-8-10-17(11-9-16)25-14-21-23-24-25)15-6-12-19(13-7-15)27-18-4-2-1-3-5-18/h1-14H,(H,22,26)
InChIKeySQMCWRNUZAZLGV-UHFFFAOYSA-N
MW357.37 g/mol
LogP3.71
Rot. Bonds5

About 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide

4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide (PubChem CID 26729233) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
PubChem CID26729233
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC Name4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-n2cnnn2)cc1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C20H15N5O2/c26-20(22-16-8-10-17(11-9-16)25-14-21-23-24-25)15-6-12-19(13-7-15)27-18-4-2-1-3-5-18/h1-14H,(H,22,26)
InChIKeySQMCWRNUZAZLGV-UHFFFAOYSA-N
XLogP3.71
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-phenoxyphenoxy)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55500018
4-iodo-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729235
N-[4-(tetrazol-1-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 7930055
N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
CID 7465186
4-[(4-phenoxybenzoyl)amino]benzoate
CID 6953062
N-[4-[[4-(tetrazol-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 9450376
4-nitro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 17011174
N-(6-phenylmethoxy-3-pyridinyl)-4-(tetrazol-1-yl)benzamide
CID 55960600
N-(4-acetamidophenyl)-4-phenoxybenzamide
CID 16651566
4-phenoxy-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922461
3-amino-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 61117464
4-tert-butyl-N-(4-phenoxyphenyl)benzamide
CID 675709

Frequently Asked Questions

What is the IUPAC name of 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide (CID 26729233) is 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide is O=C(Nc1ccc(-n2cnnn2)cc1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The InChIKey is SQMCWRNUZAZLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c26-20(22-16-8-10-17(11-9-16)25-14-21-23-24-25)15-6-12-19(13-7-15)27-18-4-2-1-3-5-18/h1-14H,(H,22,26).
What are the key properties of 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide?
4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide has a molecular weight of 357.37 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 26729233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).