4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide

C15H13N5O2 — CID 45489602

IUPAC4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2nn[nH]n2)cc1
InChIInChI=1S/C15H13N5O2/c1-22-11-8-6-10(7-9-11)15(21)16-13-5-3-2-4-12(13)14-17-19-20-18-14/h2-9H,1H3,(H,16,21)(H,17,18,19,20)
InChIKeyFZRYOABWZQVUIW-UHFFFAOYSA-N
MW295.30 g/mol
LogP2.13
Rot. Bonds4

About 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide

4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide (PubChem CID 45489602) has the molecular formula C15H13N5O2 and a molecular weight of 295.30 g/mol. Its IUPAC name is 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide
PubChem CID45489602
Molecular FormulaC15H13N5O2
Molecular Weight295.30 g/mol
Exact Mass295.11
IUPAC Name4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2nn[nH]n2)cc1
InChIInChI=1S/C15H13N5O2/c1-22-11-8-6-10(7-9-11)15(21)16-13-5-3-2-4-12(13)14-17-19-20-18-14/h2-9H,1H3,(H,16,21)(H,17,18,19,20)
InChIKeyFZRYOABWZQVUIW-UHFFFAOYSA-N
XLogP2.13
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide (CID 45489602) is 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide is COc1ccc(C(=O)Nc2ccccc2-c2nn[nH]n2)cc1.
What is the InChIKey of 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide?
The InChIKey is FZRYOABWZQVUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O2/c1-22-11-8-6-10(7-9-11)15(21)16-13-5-3-2-4-12(13)14-17-19-20-18-14/h2-9H,1H3,(H,16,21)(H,17,18,19,20).
What are the key properties of 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide?
4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide has a molecular weight of 295.30 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-(2H-tetrazol-5-yl)phenyl]benzamide is sourced from PubChem (CID 45489602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).