2-methoxy-N-(2H-tetrazol-5-yl)benzamide

C9H9N5O2 — CID 887974

IUPAC2-methoxy-N-(2H-tetrazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O2/c1-16-7-5-3-2-4-6(7)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15)
InChIKeyATALZUCFEBUDEM-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.46
Rot. Bonds3

About 2-methoxy-N-(2H-tetrazol-5-yl)benzamide

2-methoxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 887974) has the molecular formula C9H9N5O2 and a molecular weight of 219.20 g/mol. Its IUPAC name is 2-methoxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID887974
Molecular FormulaC9H9N5O2
Molecular Weight219.20 g/mol
Exact Mass219.08
IUPAC Name2-methoxy-N-(2H-tetrazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O2/c1-16-7-5-3-2-4-6(7)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15)
InChIKeyATALZUCFEBUDEM-UHFFFAOYSA-N
XLogP0.46
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Bas 07005712
CID 656143
2-methoxy-N-(7-oxo-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
CID 1877725
5-chloro-2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 648937
4-methoxy-N-(2-propyltetrazol-5-yl)benzamide
CID 900454
2-methoxy-N-[(2-propyl-2H-tetrazol-5-yl)carbamothioyl]benzamide
CID 936801
3-iodo-4-methoxy-2-propan-2-yloxy-N-(2H-tetrazol-5-yl)benzamide
CID 14276518
N-(2-Ethyl-2H-tetrazol-5-yl)-2,6-dimethoxy-benzamide
CID 650151
5-bromo-2-methoxy-N-(2-propyl-2H-tetrazol-5-yl)benzamide
CID 894139
2-ethoxy-N-(1H-tetrazol-5-yl)benzamide
CID 896527
N-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxybenzamide
CID 930080
2-methoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 1500051
5-bromo-2-methoxy-N-(2-methyltetrazol-5-yl)benzamide
CID 824050

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 2-methoxy-N-(2H-tetrazol-5-yl)benzamide (CID 887974) is 2-methoxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(2H-tetrazol-5-yl)benzamide is COc1ccccc1C(=O)Nc1nn[nH]n1.
What is the InChIKey of 2-methoxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is ATALZUCFEBUDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O2/c1-16-7-5-3-2-4-6(7)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15).
What are the key properties of 2-methoxy-N-(2H-tetrazol-5-yl)benzamide?
2-methoxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 219.20 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 887974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).