2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide

C20H24N6O — CID 133339018

IUPAC2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1ccc(-n2nnnc2N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C20H24N6O/c1-13-6-8-17(9-7-13)26-20(22-23-24-26)25(5)12-18(27)21-19-15(3)10-14(2)11-16(19)4/h6-11H,12H2,1-5H3,(H,21,27)
InChIKeyBOVIVABEQJJMJS-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.97
Rot. Bonds5

About 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide

2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 133339018) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID133339018
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1ccc(-n2nnnc2N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C20H24N6O/c1-13-6-8-17(9-7-13)26-20(22-23-24-26)25(5)12-18(27)21-19-15(3)10-14(2)11-16(19)4/h6-11H,12H2,1-5H3,(H,21,27)
InChIKeyBOVIVABEQJJMJS-UHFFFAOYSA-N
XLogP2.97
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dichlorophenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
CID 9195215
2-[methyl-(1-phenyltetrazol-5-yl)amino]-N-propylacetamide
CID 9195767
N-(5-chloro-2-methoxyphenyl)-2-[methyl-(1-phenyltetrazol-5-yl)amino]acetamide
CID 4788437
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 138400573
N-(2,6-dibromo-4-methylphenyl)-2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 35659472
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide
CID 75377260
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 9338949
2-[methyl-[2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylacetyl]amino]-N-(4-methylphenyl)acetamide
CID 2615623
2-amino-N-methyl-2-(4-methylphenyl)-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 120667422
(E)-N-methyl-3-(4-methylphenyl)-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]prop-2-enamide
CID 9219295
N,N'-bis(2,4,6-trimethylphenyl)propanediamide
CID 746178
2-[methyl(methylsulfonyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 30464677

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide (CID 133339018) is 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide is Cc1ccc(-n2nnnc2N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1.
What is the InChIKey of 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is BOVIVABEQJJMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-13-6-8-17(9-7-13)26-20(22-23-24-26)25(5)12-18(27)21-19-15(3)10-14(2)11-16(19)4/h6-11H,12H2,1-5H3,(H,21,27).
What are the key properties of 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide?
2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 364.45 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[1-(4-methylphenyl)tetrazol-5-yl]amino]-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 133339018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).