N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide

C19H21N5O — CID 16508168

IUPACN-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)Cn1nnc(-c2ccccc2)n1
InChIInChI=1S/C19H21N5O/c1-3-14-11-8-12-15(4-2)18(14)20-17(25)13-24-22-19(21-23-24)16-9-6-5-7-10-16/h5-12H,3-4,13H2,1-2H3,(H,20,25)
InChIKeyJUMMQHNUUVRWJE-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.10
Rot. Bonds6

About N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide

N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide (PubChem CID 16508168) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
PubChem CID16508168
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)Cn1nnc(-c2ccccc2)n1
InChIInChI=1S/C19H21N5O/c1-3-14-11-8-12-15(4-2)18(14)20-17(25)13-24-22-19(21-23-24)16-9-6-5-7-10-16/h5-12H,3-4,13H2,1-2H3,(H,20,25)
InChIKeyJUMMQHNUUVRWJE-UHFFFAOYSA-N
XLogP3.10
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethylphenyl)-2-(5-pyridin-4-yltetrazol-2-yl)acetamide
CID 5301595
N-(3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 856053
2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
CID 24564895
N-(4-tert-butylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508157
N-[(2-methylphenyl)methyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 8684981
2-[5-(4-ethoxyphenyl)tetrazol-2-yl]-N-(2-ethylphenyl)acetamide
CID 1136557
3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]butanoic acid
CID 119221158
2-(5-phenyltetrazol-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 16508183
N-(3,4-dimethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16561616
N-(3,5-dimethoxyphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508187
2-(5-phenyltetrazol-2-yl)acetic acid
CID 1086563
N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508158

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The IUPAC name of N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide (CID 16508168) is N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide is CCc1cccc(CC)c1NC(=O)Cn1nnc(-c2ccccc2)n1.
What is the InChIKey of N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The InChIKey is JUMMQHNUUVRWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-3-14-11-8-12-15(4-2)18(14)20-17(25)13-24-22-19(21-23-24)16-9-6-5-7-10-16/h5-12H,3-4,13H2,1-2H3,(H,20,25).
What are the key properties of N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide?
N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide has a molecular weight of 335.41 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide is sourced from PubChem (CID 16508168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).