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

C10H11N5O2 — CID 896527

IUPAC2-ethoxy-N-(2H-tetrazol-5-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C10H11N5O2/c1-2-17-8-6-4-3-5-7(8)9(16)11-10-12-14-15-13-10/h3-6H,2H2,1H3,(H2,11,12,13,14,15,16)
InChIKeyJZGRVVCXRKFNFF-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.85
Rot. Bonds4

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

2-ethoxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 896527) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID896527
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name2-ethoxy-N-(2H-tetrazol-5-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C10H11N5O2/c1-2-17-8-6-4-3-5-7(8)9(16)11-10-12-14-15-13-10/h3-6H,2H2,1H3,(H2,11,12,13,14,15,16)
InChIKeyJZGRVVCXRKFNFF-UHFFFAOYSA-N
XLogP0.85
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Bas 07005712
CID 656143
5-chloro-2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 648937
3-ethoxy-N-(2-propyl-2H-tetrazol-5-yl)benzamide
CID 893318
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
3-Propoxy-N-(2-propyl-2H-tetrazol-5-yl)-benzamide
CID 649277
4-ethoxy-N-(2-ethyl-2H-tetrazol-5-yl)benzamide
CID 654362
2-ethoxy-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 750667
2-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide
CID 871221
5-bromo-2-methoxy-N-(2-propyl-2H-tetrazol-5-yl)benzamide
CID 894139
N-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methoxybenzamide
CID 930080

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide (CID 896527) is 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide is CCOc1ccccc1C(=O)Nc1nn[nH]n1.
What is the InChIKey of 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is JZGRVVCXRKFNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-2-17-8-6-4-3-5-7(8)9(16)11-10-12-14-15-13-10/h3-6H,2H2,1H3,(H2,11,12,13,14,15,16).
What are the key properties of 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide?
2-ethoxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 233.23 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 896527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).