5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide

C11H10ClN5O2 — CID 17162681

IUPAC5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide
SMILESC=Cn1nnc(NC(=O)c2cc(Cl)ccc2OC)n1
InChIInChI=1S/C11H10ClN5O2/c1-3-17-15-11(14-16-17)13-10(18)8-6-7(12)4-5-9(8)19-2/h3-6H,1H2,2H3,(H,13,15,18)
InChIKeyGCVLNGDSTBIGHE-UHFFFAOYSA-N
MW279.69 g/mol
LogP1.69
Rot. Bonds4

About 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide

5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide (PubChem CID 17162681) has the molecular formula C11H10ClN5O2 and a molecular weight of 279.69 g/mol. Its IUPAC name is 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide.

Molecular Properties

Compound Name5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide
PubChem CID17162681
Molecular FormulaC11H10ClN5O2
Molecular Weight279.69 g/mol
Exact Mass279.05
IUPAC Name5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide
SMILESC=Cn1nnc(NC(=O)c2cc(Cl)ccc2OC)n1
InChIInChI=1S/C11H10ClN5O2/c1-3-17-15-11(14-16-17)13-10(18)8-6-7(12)4-5-9(8)19-2/h3-6H,1H2,2H3,(H,13,15,18)
InChIKeyGCVLNGDSTBIGHE-UHFFFAOYSA-N
XLogP1.69
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.69
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,4-dichloro-N-(2-ethenyltetrazol-5-yl)benzamide
CID 17162644
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
5-chloro-N-(1H-imidazol-2-yl)-2-methoxybenzamide
CID 60967782
5-chloro-N-(1-ethylpyrazol-3-yl)-2-methoxybenzamide
CID 35286166
N-(5-amino-1,3,4-thiadiazol-2-yl)-5-chloro-2-methoxybenzamide
CID 79516243
methyl 4-[(5-chloro-2-methoxybenzoyl)amino]-1,3-dimethylpyrazole-5-carboxylate
CID 95749032
2,6-dichloro-N'-(5-chloro-2-methoxybenzoyl)benzohydrazide
CID 78775260
5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
5-chloro-2-methoxy-N-(2-piperidin-1-ylpyrimidin-5-yl)benzamide
CID 53164660
N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928
5-chloro-N-[1-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-methoxybenzamide
CID 19341336
5-chloro-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
CID 762528

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide?
The IUPAC name of 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide (CID 17162681) is 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide.
What is the SMILES notation for 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide?
The canonical SMILES for 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide is C=Cn1nnc(NC(=O)c2cc(Cl)ccc2OC)n1.
What is the InChIKey of 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide?
The InChIKey is GCVLNGDSTBIGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN5O2/c1-3-17-15-11(14-16-17)13-10(18)8-6-7(12)4-5-9(8)19-2/h3-6H,1H2,2H3,(H,13,15,18).
What are the key properties of 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide?
5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide has a molecular weight of 279.69 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-ethenyltetrazol-5-yl)-2-methoxybenzamide is sourced from PubChem (CID 17162681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).