3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide

C175H299N21O48 — CID 158586163

IUPAC3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(N2CCN(C)CC2)CC1.COCCCCCOCc1cc(C)on1.COCCCCCc1cc(C)on1.COCCCCOCCc1cc(C)on1.COCCCCOCc1cc(C)on1.COCCCCc1cc(C)on1.COCCCOCCCc1cc(C)on1.COCCCOCCc1cc(C)on1.COCCCOCc1cc(C)on1.COCCCc1cc(C)on1.COCCOCCCCCc1cc(C)on1.COCCOCCCCc1cc(C)on1.COCCOCCCc1cc(C)on1.COCCOCCOCc1cc(C)on1.COCCOCCc1cc(C)on1.COCCOCc1cc(C)on1.COCCc1cc(C)on1.COCc1cc(C)on1
InChIInChI=1S/C13H26N4O.C12H21NO3.4C11H19NO3.C10H17NO4.3C10H17NO3.C10H17NO2.2C9H15NO3.C9H15NO2.C8H13NO3.C8H13NO2.C7H11NO2.C6H9NO2/c1-14-13(18)11-16-5-3-12(4-6-16)17-9-7-15(2)8-10-17;1-11-10-12(13-16-11)6-4-3-5-7-15-9-8-14-2;1-10-9-11(12-15-10)5-3-7-14-8-4-6-13-2;1-10-9-11(12-15-10)5-8-14-7-4-3-6-13-2;1-10-9-11(12-15-10)5-3-4-6-14-8-7-13-2;1-10-8-11(12-15-10)9-14-7-5-3-4-6-13-2;1-9-7-10(11-15-9)8-14-6-5-13-4-3-12-2;1-9-8-10(11-14-9)4-7-13-6-3-5-12-2;1-9-8-10(11-14-9)4-3-5-13-7-6-12-2;1-9-7-10(11-14-9)8-13-6-4-3-5-12-2;1-9-8-10(11-13-9)6-4-3-5-7-12-2;1-8-7-9(10-13-8)3-4-12-6-5-11-2;1-8-6-9(10-13-8)7-12-5-3-4-11-2;1-8-7-9(10-12-8)5-3-4-6-11-2;1-7-5-8(9-12-7)6-11-4-3-10-2;1-7-6-8(9-11-7)4-3-5-10-2;1-6-5-7(8-10-6)3-4-9-2;1-5-3-6(4-8-2)7-9-5/h12H,3-11H2,1-2H3,(H,14,18);10H,3-9H2,1-2H3;3*9H,3-8H2,1-2H3;8H,3-7,9H2,1-2H3;7H,3-6,8H2,1-2H3;2*8H,3-7H2,1-2H3;7H,3-6,8H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5,7H2,1-2H3;7H,3-6H2,1-2H3;5H,3-4,6H2,1-2H3;6H,3-5H2,1-2H3;5H,3-4H2,1-2H3;3H,4H2,1-2H3
InChIKeyHTVSLLSNCGRIRO-UHFFFAOYSA-N
MW3465.42 g/mol
LogP28.30
Rot. Bonds110

About 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide

3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide (PubChem CID 158586163) has the molecular formula C175H299N21O48 and a molecular weight of 3465.42 g/mol. Its IUPAC name is 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide
PubChem CID158586163
Molecular FormulaC175H299N21O48
Molecular Weight3465.42 g/mol
Exact Mass3463.16
IUPAC Name3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(N2CCN(C)CC2)CC1.COCCCCCOCc1cc(C)on1.COCCCCCc1cc(C)on1.COCCCCOCCc1cc(C)on1.COCCCCOCc1cc(C)on1.COCCCCc1cc(C)on1.COCCCOCCCc1cc(C)on1.COCCCOCCc1cc(C)on1.COCCCOCc1cc(C)on1.COCCCc1cc(C)on1.COCCOCCCCCc1cc(C)on1.COCCOCCCCc1cc(C)on1.COCCOCCCc1cc(C)on1.COCCOCCOCc1cc(C)on1.COCCOCCc1cc(C)on1.COCCOCc1cc(C)on1.COCCc1cc(C)on1.COCc1cc(C)on1
InChIInChI=1S/C13H26N4O.C12H21NO3.4C11H19NO3.C10H17NO4.3C10H17NO3.C10H17NO2.2C9H15NO3.C9H15NO2.C8H13NO3.C8H13NO2.C7H11NO2.C6H9NO2/c1-14-13(18)11-16-5-3-12(4-6-16)17-9-7-15(2)8-10-17;1-11-10-12(13-16-11)6-4-3-5-7-15-9-8-14-2;1-10-9-11(12-15-10)5-3-7-14-8-4-6-13-2;1-10-9-11(12-15-10)5-8-14-7-4-3-6-13-2;1-10-9-11(12-15-10)5-3-4-6-14-8-7-13-2;1-10-8-11(12-15-10)9-14-7-5-3-4-6-13-2;1-9-7-10(11-15-9)8-14-6-5-13-4-3-12-2;1-9-8-10(11-14-9)4-7-13-6-3-5-12-2;1-9-8-10(11-14-9)4-3-5-13-7-6-12-2;1-9-7-10(11-14-9)8-13-6-4-3-5-12-2;1-9-8-10(11-13-9)6-4-3-5-7-12-2;1-8-7-9(10-13-8)3-4-12-6-5-11-2;1-8-6-9(10-13-8)7-12-5-3-4-11-2;1-8-7-9(10-12-8)5-3-4-6-11-2;1-7-5-8(9-12-7)6-11-4-3-10-2;1-7-6-8(9-11-7)4-3-5-10-2;1-6-5-7(8-10-6)3-4-9-2;1-5-3-6(4-8-2)7-9-5/h12H,3-11H2,1-2H3,(H,14,18);10H,3-9H2,1-2H3;3*9H,3-8H2,1-2H3;8H,3-7,9H2,1-2H3;7H,3-6,8H2,1-2H3;2*8H,3-7H2,1-2H3;7H,3-6,8H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5,7H2,1-2H3;7H,3-6H2,1-2H3;5H,3-4,6H2,1-2H3;6H,3-5H2,1-2H3;5H,3-4H2,1-2H3;3H,4H2,1-2H3
InChIKeyHTVSLLSNCGRIRO-UHFFFAOYSA-N
XLogP28.30
TPSA758.23 Ų
H-Bond Donors1
H-Bond Acceptors68
Rotatable Bonds110
Heavy Atoms244
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003465.42
LogP ≤ 528.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1068

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide?
The IUPAC name of 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide (CID 158586163) is 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide?
The canonical SMILES for 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide is CNC(=O)CN1CCC(N2CCN(C)CC2)CC1.COCCCCCOCc1cc(C)on1.COCCCCCc1cc(C)on1.COCCCCOCCc1cc(C)on1.COCCCCOCc1cc(C)on1.COCCCCc1cc(C)on1.COCCCOCCCc1cc(C)on1.COCCCOCCc1cc(C)on1.COCCCOCc1cc(C)on1.COCCCc1cc(C)on1.COCCOCCCCCc1cc(C)on1.COCCOCCCCc1cc(C)on1.COCCOCCCc1cc(C)on1.COCCOCCOCc1cc(C)on1.COCCOCCc1cc(C)on1.COCCOCc1cc(C)on1.COCCc1cc(C)on1.COCc1cc(C)on1.
What is the InChIKey of 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide?
The InChIKey is HTVSLLSNCGRIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O.C12H21NO3.4C11H19NO3.C10H17NO4.3C10H17NO3.C10H17NO2.2C9H15NO3.C9H15NO2.C8H13NO3.C8H13NO2.C7H11NO2.C6H9NO2/c1-14-13(18)11-16-5-3-12(4-6-16)17-9-7-15(2)8-10-17;1-11-10-12(13-16-11)6-4-3-5-7-15-9-8-14-2;1-10-9-11(12-15-10)5-3-7-14-8-4-6-13-2;1-10-9-11(12-15-10)5-8-14-7-4-3-6-13-2;1-10-9-11(12-15-10)5-3-4-6-14-8-7-13-2;1-10-8-11(12-15-10)9-14-7-5-3-4-6-13-2;1-9-7-10(11-15-9)8-14-6-5-13-4-3-12-2;1-9-8-10(11-14-9)4-7-13-6-3-5-12-2;1-9-8-10(11-14-9)4-3-5-13-7-6-12-2;1-9-7-10(11-14-9)8-13-6-4-3-5-12-2;1-9-8-10(11-13-9)6-4-3-5-7-12-2;1-8-7-9(10-13-8)3-4-12-6-5-11-2;1-8-6-9(10-13-8)7-12-5-3-4-11-2;1-8-7-9(10-12-8)5-3-4-6-11-2;1-7-5-8(9-12-7)6-11-4-3-10-2;1-7-6-8(9-11-7)4-3-5-10-2;1-6-5-7(8-10-6)3-4-9-2;1-5-3-6(4-8-2)7-9-5/h12H,3-11H2,1-2H3,(H,14,18);10H,3-9H2,1-2H3;3*9H,3-8H2,1-2H3;8H,3-7,9H2,1-2H3;7H,3-6,8H2,1-2H3;2*8H,3-7H2,1-2H3;7H,3-6,8H2,1-2H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5,7H2,1-2H3;7H,3-6H2,1-2H3;5H,3-4,6H2,1-2H3;6H,3-5H2,1-2H3;5H,3-4H2,1-2H3;3H,4H2,1-2H3.
What are the key properties of 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide?
3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide has a molecular weight of 3465.42 g/mol, XLogP of 28.30, 110 rotatable bonds, 1 hydrogen bond donors, and 68 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-methoxybutoxy)ethyl]-5-methyl-1,2-oxazole;3-(4-methoxybutoxymethyl)-5-methyl-1,2-oxazole;3-(4-methoxybutyl)-5-methyl-1,2-oxazole;3-[4-(2-methoxyethoxy)butyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethoxymethyl]-5-methyl-1,2-oxazole;3-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,2-oxazole;3-(2-methoxyethoxymethyl)-5-methyl-1,2-oxazole;3-[5-(2-methoxyethoxy)pentyl]-5-methyl-1,2-oxazole;3-[3-(2-methoxyethoxy)propyl]-5-methyl-1,2-oxazole;3-(2-methoxyethyl)-5-methyl-1,2-oxazole;3-(methoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentoxymethyl)-5-methyl-1,2-oxazole;3-(5-methoxypentyl)-5-methyl-1,2-oxazole;3-[2-(3-methoxypropoxy)ethyl]-5-methyl-1,2-oxazole;3-(3-methoxypropoxymethyl)-5-methyl-1,2-oxazole;3-[3-(3-methoxypropoxy)propyl]-5-methyl-1,2-oxazole;3-(3-methoxypropyl)-5-methyl-1,2-oxazole;N-methyl-2-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 158586163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).