N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide

C15H13N5O2 — CID 777207

IUPACN-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H13N5O2/c1-22-14-5-3-2-4-13(14)17-15(21)11-6-8-12(9-7-11)20-10-16-18-19-20/h2-10H,1H3,(H,17,21)
InChIKeyALJZFUNHEUBSCR-UHFFFAOYSA-N
MW295.30 g/mol
LogP1.92
Rot. Bonds4

About N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide

N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide (PubChem CID 777207) has the molecular formula C15H13N5O2 and a molecular weight of 295.30 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide
PubChem CID777207
Molecular FormulaC15H13N5O2
Molecular Weight295.30 g/mol
Exact Mass295.11
IUPAC NameN-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H13N5O2/c1-22-14-5-3-2-4-13(14)17-15(21)11-6-8-12(9-7-11)20-10-16-18-19-20/h2-10H,1H3,(H,17,21)
InChIKeyALJZFUNHEUBSCR-UHFFFAOYSA-N
XLogP1.92
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide (CID 777207) is N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide is COc1ccccc1NC(=O)c1ccc(-n2cnnn2)cc1.
What is the InChIKey of N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide?
The InChIKey is ALJZFUNHEUBSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O2/c1-22-14-5-3-2-4-13(14)17-15(21)11-6-8-12(9-7-11)20-10-16-18-19-20/h2-10H,1H3,(H,17,21).
What are the key properties of N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide?
N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide has a molecular weight of 295.30 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 777207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).