2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide

C17H23N5O2 — CID 953175

IUPAC2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide
SMILESCCn1nnc(NC(=O)COc2ccc(C3CCCCC3)cc2)n1
InChIInChI=1S/C17H23N5O2/c1-2-22-20-17(19-21-22)18-16(23)12-24-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20,23)
InChIKeyJMZOELNNFNASNR-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.76
Rot. Bonds6

About 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide

2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide (PubChem CID 953175) has the molecular formula C17H23N5O2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide
PubChem CID953175
Molecular FormulaC17H23N5O2
Molecular Weight329.40 g/mol
Exact Mass329.19
IUPAC Name2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide
SMILESCCn1nnc(NC(=O)COc2ccc(C3CCCCC3)cc2)n1
InChIInChI=1S/C17H23N5O2/c1-2-22-20-17(19-21-22)18-16(23)12-24-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20,23)
InChIKeyJMZOELNNFNASNR-UHFFFAOYSA-N
XLogP2.76
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-cyclohexylphenoxy)-N-[4-(diethylaminomethyl)phenyl]acetamide
CID 19630470
N-[(2-ethyltetrazol-5-yl)carbamothioyl]-2-phenoxyacetamide
CID 953658
4-[[2-(4-cyclohexylphenoxy)acetyl]amino]benzoic acid
CID 17172239
2-(4-nitrophenoxy)-N-(2-propyltetrazol-5-yl)acetamide
CID 894286
2-[4-[(2R)-butan-2-yl]phenoxy]-N-(2-propyltetrazol-5-yl)acetamide
CID 955478
2-(4-cyclohexylphenoxy)-N-naphthalen-2-ylacetamide
CID 21234083
2-(3,4-dimethylphenoxy)-N-(2-propyltetrazol-5-yl)acetamide
CID 954289
2-(4-cyclohexylphenoxy)-N-[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]acetamide
CID 5114131
2-(4-cyclohexylphenoxy)-N-[2-(4-fluorophenyl)benzotriazol-5-yl]acetamide
CID 17111035
2-(4-cyclohexylphenoxy)-N-(4-iodo-2,5-dimethylphenyl)acetamide
CID 23095771
2-(4-cyclohexylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide
CID 7106089
2-(4-cyclohexylphenoxy)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide
CID 7441969

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide?
The IUPAC name of 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide (CID 953175) is 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide is CCn1nnc(NC(=O)COc2ccc(C3CCCCC3)cc2)n1.
What is the InChIKey of 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide?
The InChIKey is JMZOELNNFNASNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O2/c1-2-22-20-17(19-21-22)18-16(23)12-24-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-11,13H,2-7,12H2,1H3,(H,18,20,23).
What are the key properties of 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide?
2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide has a molecular weight of 329.40 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexylphenoxy)-N-(2-ethyltetrazol-5-yl)acetamide is sourced from PubChem (CID 953175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).