2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide

C17H30N4O2 — CID 51133220

IUPAC2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide
SMILESCC(C)(C)c1nc(CN(CCC2CCCCC2)CC(N)=O)no1
InChIInChI=1S/C17H30N4O2/c1-17(2,3)16-19-15(20-23-16)12-21(11-14(18)22)10-9-13-7-5-4-6-8-13/h13H,4-12H2,1-3H3,(H2,18,22)
InChIKeyQONKPMMDQLTJOY-UHFFFAOYSA-N
MW322.45 g/mol
LogP2.62
Rot. Bonds7

About 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide

2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide (PubChem CID 51133220) has the molecular formula C17H30N4O2 and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide.

Molecular Properties

Compound Name2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide
PubChem CID51133220
Molecular FormulaC17H30N4O2
Molecular Weight322.45 g/mol
Exact Mass322.24
IUPAC Name2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide
SMILESCC(C)(C)c1nc(CN(CCC2CCCCC2)CC(N)=O)no1
InChIInChI=1S/C17H30N4O2/c1-17(2,3)16-19-15(20-23-16)12-21(11-14(18)22)10-9-13-7-5-4-6-8-13/h13H,4-12H2,1-3H3,(H2,18,22)
InChIKeyQONKPMMDQLTJOY-UHFFFAOYSA-N
XLogP2.62
TPSA85.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide with MolForge

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Related Compounds

N-(ethylcarbamoyl)-2-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]amino]acetamide
CID 47075221
2-[2-Cyclohexylethyl-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
CID 51107248
2-Cyclohexyl-1-[4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]ethanone
CID 53557514
2-[2-Cyclohexylethyl-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
CID 53566393
N-[(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methyl]-1-ethyl-5-oxo-3-pyrrolidinecarboxamide
CID 72886580
1-[(3-Methyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carboxamide
CID 32829898
(1S)-N-(cyclohexylmethyl)-N-methyl-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethanamine
CID 39998277
2-[1-[(3-Ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]acetamide
CID 51081956
5-tert-butyl-3-[[(2S)-2-cyclohexylpyrrolidin-1-yl]methyl]-1,2,4-oxadiazole
CID 52511253
2-[1-[(3-Propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]acetamide
CID 53521690
1-butyryl-N-[(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-amine
CID 56718197
{1-[(5-Tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl}methanamine
CID 61800297

Frequently Asked Questions

What is the IUPAC name of 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide?
The IUPAC name of 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide (CID 51133220) is 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide.
What is the SMILES notation for 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide?
The canonical SMILES for 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide is CC(C)(C)c1nc(CN(CCC2CCCCC2)CC(N)=O)no1.
What is the InChIKey of 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide?
The InChIKey is QONKPMMDQLTJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O2/c1-17(2,3)16-19-15(20-23-16)12-21(11-14(18)22)10-9-13-7-5-4-6-8-13/h13H,4-12H2,1-3H3,(H2,18,22).
What are the key properties of 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide?
2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide has a molecular weight of 322.45 g/mol, XLogP of 2.62, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl-(2-cyclohexylethyl)amino]acetamide is sourced from PubChem (CID 51133220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).