N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide

C20H30N6O2 — CID 142067483

IUPACN-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1(C)CCN(CCOc2nnnn2CC)CC1
InChIInChI=1S/C20H30N6O2/c1-4-18(27)26(17-9-7-6-8-10-17)20(3)11-13-24(14-12-20)15-16-28-19-21-22-23-25(19)5-2/h6-10H,4-5,11-16H2,1-3H3
InChIKeyFEVKQMXKZQUSLN-UHFFFAOYSA-N
MW386.50 g/mol
LogP2.37
Rot. Bonds8

About N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide

N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide (PubChem CID 142067483) has the molecular formula C20H30N6O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide.

Molecular Properties

Compound NameN-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide
PubChem CID142067483
Molecular FormulaC20H30N6O2
Molecular Weight386.50 g/mol
Exact Mass386.24
IUPAC NameN-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1(C)CCN(CCOc2nnnn2CC)CC1
InChIInChI=1S/C20H30N6O2/c1-4-18(27)26(17-9-7-6-8-10-17)20(3)11-13-24(14-12-20)15-16-28-19-21-22-23-25(19)5-2/h6-10H,4-5,11-16H2,1-3H3
InChIKeyFEVKQMXKZQUSLN-UHFFFAOYSA-N
XLogP2.37
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-Fluoro-phenyl)-2-methoxy-N-[3-methyl-1-(2-tetrazol-1-yl-ethyl)-piperidin-4-yl]-acetamide
CID 44329407
[4-(N-propanoylanilino)-1-[2-(tetrazol-2-yl)ethyl]piperidin-4-yl]methyl acetate
CID 14494499
N-[4-(methoxymethyl)-1-[2-(tetrazol-2-yl)ethyl]piperidin-4-yl]-N-phenylpropanamide
CID 14879880
N-[4-(methoxymethyl)-1-[2-(5-morpholin-4-yltetrazol-2-yl)ethyl]piperidin-4-yl]-N-phenylpropanamide
CID 14879882
methyl 4-(N-propanoylanilino)-1-[2-(1,2,4-triazol-1-yl)ethyl]piperidine-4-carboxylate
CID 14879877
N-[4-(methoxymethyl)-1-[2-(1,2,4-triazol-1-yl)ethyl]piperidin-4-yl]-N-phenylpropanamide
CID 14879878
2-methoxy-N-[3-methyl-1-[2-(tetrazol-1-yl)ethyl]piperidin-4-yl]-N-phenylpropanamide
CID 44329302
N-(2-fluorophenyl)-2-methoxy-N-[3-methyl-1-[2-(tetrazol-1-yl)ethyl]piperidin-4-yl]propanamide
CID 44329514
2-methoxy-N-[3-methyl-1-[2-(tetrazol-1-yl)ethyl]piperidin-4-yl]-N-phenylacetamide
CID 44329589
5-(1-Butyltetrazol-5-yl)-5-methyl-1-(4-morpholin-4-ylphenyl)pyrrolidin-2-one
CID 53300769
2-[3-fluoro-4-(1-methyltetrazol-5-yl)piperazin-1-yl]-N-methyl-N-(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)acetamide
CID 67664619
1-[1-[1-(2-Methoxyethyl)tetrazol-5-yl]-2-methylpropyl]-4-phenylpiperazine
CID 44753124

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide?
The IUPAC name of N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide (CID 142067483) is N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide.
What is the SMILES notation for N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide?
The canonical SMILES for N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide is CCC(=O)N(c1ccccc1)C1(C)CCN(CCOc2nnnn2CC)CC1.
What is the InChIKey of N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide?
The InChIKey is FEVKQMXKZQUSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N6O2/c1-4-18(27)26(17-9-7-6-8-10-17)20(3)11-13-24(14-12-20)15-16-28-19-21-22-23-25(19)5-2/h6-10H,4-5,11-16H2,1-3H3.
What are the key properties of N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide?
N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide has a molecular weight of 386.50 g/mol, XLogP of 2.37, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(1-ethyltetrazol-5-yl)oxyethyl]-4-methylpiperidin-4-yl]-N-phenylpropanamide is sourced from PubChem (CID 142067483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).