N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide

C16H15N5O — CID 2612876

IUPACN-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C16H15N5O/c22-16(11-21-12-17-19-20-21)18-15-9-5-4-8-14(15)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,18,22)
InChIKeySEFZKFJTXRHBQO-UHFFFAOYSA-N
MW293.33 g/mol
LogP1.90
Rot. Bonds5

About N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide

N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide (PubChem CID 2612876) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide
PubChem CID2612876
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC NameN-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C16H15N5O/c22-16(11-21-12-17-19-20-21)18-15-9-5-4-8-14(15)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,18,22)
InChIKeySEFZKFJTXRHBQO-UHFFFAOYSA-N
XLogP1.90
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide (CID 2612876) is N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide is O=C(Cn1cnnn1)Nc1ccccc1Cc1ccccc1.
What is the InChIKey of N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide?
The InChIKey is SEFZKFJTXRHBQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c22-16(11-21-12-17-19-20-21)18-15-9-5-4-8-14(15)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,18,22).
What are the key properties of N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide?
N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide has a molecular weight of 293.33 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 2612876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).