N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide

C15H21N5O2 — CID 953039

IUPACN-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
SMILESCCn1nnc(NC(=O)COc2cc(C)ccc2C(C)C)n1
InChIInChI=1S/C15H21N5O2/c1-5-20-18-15(17-19-20)16-14(21)9-22-13-8-11(4)6-7-12(13)10(2)3/h6-8,10H,5,9H2,1-4H3,(H,16,18,21)
InChIKeyXLODZQMLMZJQEJ-UHFFFAOYSA-N
MW303.37 g/mol
LogP2.14
Rot. Bonds6

About N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide

N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide (PubChem CID 953039) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
PubChem CID953039
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC NameN-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
SMILESCCn1nnc(NC(=O)COc2cc(C)ccc2C(C)C)n1
InChIInChI=1S/C15H21N5O2/c1-5-20-18-15(17-19-20)16-14(21)9-22-13-8-11(4)6-7-12(13)10(2)3/h6-8,10H,5,9H2,1-4H3,(H,16,18,21)
InChIKeyXLODZQMLMZJQEJ-UHFFFAOYSA-N
XLogP2.14
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-ethylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893388
2-(4-cyclohexylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893627
2-(2-isopropyl-5-methylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 2193871
2-(2,4-Dimethyl-phenoxy)-N-(2-methyl-2H-tetrazol-5-yl)-acetamide
CID 654531
2-(4-cyclohexylphenoxy)-N-(2-methyl-2H-tetrazol-5-yl)acetamide
CID 936003
2-(4-cyclohexylphenoxy)-N-(2-ethyl-2H-tetrazol-5-yl)acetamide
CID 953175
N-(2-butyl-2H-tetrazol-5-yl)-2-(2-isopropyl-5-methylphenoxy)acetamide
CID 2219063
2-(4-ethylphenoxy)-N-(1-propyl-1H-tetraazol-5-yl)acetamide
CID 851477
2-(2,3-dimethylphenoxy)-N-(2-methyl-2H-tetrazol-5-yl)acetamide
CID 953413
N-(2-butyl-2H-tetrazol-5-yl)-2-(4-chloro-3-methylphenoxy)acetamide
CID 2219062
2-(2,5-dimethylphenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 733458
2-(4-chloro-2-methylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893324

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide (CID 953039) is N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide is CCn1nnc(NC(=O)COc2cc(C)ccc2C(C)C)n1.
What is the InChIKey of N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The InChIKey is XLODZQMLMZJQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-5-20-18-15(17-19-20)16-14(21)9-22-13-8-11(4)6-7-12(13)10(2)3/h6-8,10H,5,9H2,1-4H3,(H,16,18,21).
What are the key properties of N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide has a molecular weight of 303.37 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltetrazol-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 953039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).