2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride

C11H12Cl3N5O2 — CID 126468098

IUPAC2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride
SMILESCCn1nnc(NC(=O)COc2ccc(Cl)cc2Cl)n1.Cl
InChIInChI=1S/C11H11Cl2N5O2.ClH/c1-2-18-16-11(15-17-18)14-10(19)6-20-9-4-3-7(12)5-8(9)13;/h3-5H,2,6H2,1H3,(H,14,16,19);1H
InChIKeyCPAPEIFJDPRKOQ-UHFFFAOYSA-N
MW352.61 g/mol
LogP2.44
Rot. Bonds5

About 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride

2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride (PubChem CID 126468098) has the molecular formula C11H12Cl3N5O2 and a molecular weight of 352.61 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride
PubChem CID126468098
Molecular FormulaC11H12Cl3N5O2
Molecular Weight352.61 g/mol
Exact Mass351.01
IUPAC Name2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride
SMILESCCn1nnc(NC(=O)COc2ccc(Cl)cc2Cl)n1.Cl
InChIInChI=1S/C11H11Cl2N5O2.ClH/c1-2-18-16-11(15-17-18)14-10(19)6-20-9-4-3-7(12)5-8(9)13;/h3-5H,2,6H2,1H3,(H,14,16,19);1H
InChIKeyCPAPEIFJDPRKOQ-UHFFFAOYSA-N
XLogP2.44
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.61
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-butyltetrazol-5-yl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 3502326
2-(2,4-dichlorophenoxy)-N-(thiatriazol-5-yl)acetamide
CID 19114260
N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 1039828
methyl 4-[[2-(2,4-dichlorophenoxy)acetyl]amino]-1,3-dimethylpyrazole-5-carboxylate
CID 95749035
2-(2,4-dichlorophenoxy)-N-[4-[4-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-methylphenyl]-2-methylphenyl]acetamide
CID 2827268
2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
2-(2,4-dichlorophenoxy)-N-[5-(propan-2-ylamino)-2-pyridinyl]acetamide
CID 113023590
2-(2,4-dichlorophenoxy)-N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 3158232
2-(2,4-dichlorophenoxy)-N-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]acetamide
CID 52584664
(2R)-N-(2-butyltetrazol-5-yl)-2-(2,4-dichlorophenoxy)propanamide
CID 7368682
2-(2,4-dichlorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 976414
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride (CID 126468098) is 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride is CCn1nnc(NC(=O)COc2ccc(Cl)cc2Cl)n1.Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride?
The InChIKey is CPAPEIFJDPRKOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2N5O2.ClH/c1-2-18-16-11(15-17-18)14-10(19)6-20-9-4-3-7(12)5-8(9)13;/h3-5H,2,6H2,1H3,(H,14,16,19);1H.
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride?
2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride has a molecular weight of 352.61 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(2-ethyltetrazol-5-yl)acetamide;hydrochloride is sourced from PubChem (CID 126468098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).