8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine

C181H370N20O12 — CID 167585345

About 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine

8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine (PubChem CID 167585345) has the molecular formula C181H370N20O12 and a molecular weight of 3019.08 g/mol. Its IUPAC name is 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine.

Molecular Properties

• Compound Name: 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine
• PubChem CID: 167585345
• Molecular Formula: C181H370N20O12
• Molecular Weight: 3019.08 g/mol
• Exact Mass: 3016.90
• IUPAC Name: 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine
• SMILES: CC(C)(C)CC1CCC(CN2CCC(C(C)(C)C)CC2)CC1.CC(C)(C)CCCN1CCN(C(C)(C)C)CC1.CC(C)(C)CCCOCCOCCOCCCC(=O)C(C)(C)C.CC(C)(C)CCN1CCN(CC(=O)N2CCC(C)(C(C)(C)C)CC2)CC1.CC(C)(C)CCN1CCN(CC(=O)N2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)CCNC(C)(C)C.CC(C)(C)NCCCCCC(=O)C(C)(C)C.CC(C)(C)OCCCNC(=O)CCCN1CCN(C(C)(C)C)CC1.CC(C)C1(C)CCN(C(=O)CCCN2CCN(C(C)(C)C)CC2)CC1.CC(C)NCCCC(=O)C(C)(C)C.CC(C)NCCCOC(C)C
• InChI: InChI=1S/C22H43N3O.C21H41N3O.C21H41N.C20H40N4O.C19H39N3O2.C19H38O4.C15H32N2.C14H29NO.C11H23NO.C10H23N.C9H21NO/c1-20(2,3)8-11-23-14-16-24(17-15-23)18-19(26)25-12-9-22(7,10-13-25)21(4,5)6;1-18(2)21(6)9-12-23(13-10-21)19(25)8-7-11-22-14-16-24(17-15-22)20(3,4)5;1-20(2,3)15-17-7-9-18(10-8-17)16-22-13-11-19(12-14-22)21(4,5)6;1-19(2,3)7-8-21-9-11-22(12-10-21)17-18(25)23-13-15-24(16-14-23)20(4,5)6;1-18(2,3)22-14-12-21(13-15-22)11-7-9-17(23)20-10-8-16-24-19(4,5)6;1-18(2,3)10-8-12-22-14-16-23-15-13-21-11-7-9-17(20)19(4,5)6;1-14(2,3)8-7-9-16-10-12-17(13-11-16)15(4,5)6;1-13(2,3)12(16)10-8-7-9-11-15-14(4,5)6;1-9(2)12-8-6-7-10(13)11(3,4)5;1-9(2,3)7-8-11-10(4,5)6;1-8(2)10-6-5-7-11-9(3)4/h8-18H2,1-7H3;18H,7-17H2,1-6H3;17-19H,7-16H2,1-6H3;7-17H2,1-6H3;7-16H2,1-6H3,(H,20,23);7-16H2,1-6H3;7-13H2,1-6H3;15H,7-11H2,1-6H3;9,12H,6-8H2,1-5H3;11H,7-8H2,1-6H3;8-10H,5-7H2,1-4H3
• InChIKey: HSNICFNSJXGAON-UHFFFAOYSA-N
• XLogP: 35.68
• TPSA: 274.39 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 28
• Rotatable Bonds: 59
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3019.08
LogP ≤ 5	35.68
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine?

The IUPAC name of 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine (CID 167585345) is 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine.

What is the SMILES notation for 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine?

The canonical SMILES for 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine is CC(C)(C)CC1CCC(CN2CCC(C(C)(C)C)CC2)CC1.CC(C)(C)CCCN1CCN(C(C)(C)C)CC1.CC(C)(C)CCCOCCOCCOCCCC(=O)C(C)(C)C.CC(C)(C)CCN1CCN(CC(=O)N2CCC(C)(C(C)(C)C)CC2)CC1.CC(C)(C)CCN1CCN(CC(=O)N2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)CCNC(C)(C)C.CC(C)(C)NCCCCCC(=O)C(C)(C)C.CC(C)(C)OCCCNC(=O)CCCN1CCN(C(C)(C)C)CC1.CC(C)C1(C)CCN(C(=O)CCCN2CCN(C(C)(C)C)CC2)CC1.CC(C)NCCCC(=O)C(C)(C)C.CC(C)NCCCOC(C)C.

What is the InChIKey of 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine?

The InChIKey is HSNICFNSJXGAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H43N3O.C21H41N3O.C21H41N.C20H40N4O.C19H39N3O2.C19H38O4.C15H32N2.C14H29NO.C11H23NO.C10H23N.C9H21NO/c1-20(2,3)8-11-23-14-16-24(17-15-23)18-19(26)25-12-9-22(7,10-13-25)21(4,5)6;1-18(2)21(6)9-12-23(13-10-21)19(25)8-7-11-22-14-16-24(17-15-22)20(3,4)5;1-20(2,3)15-17-7-9-18(10-8-17)16-22-13-11-19(12-14-22)21(4,5)6;1-19(2,3)7-8-21-9-11-22(12-10-21)17-18(25)23-13-15-24(16-14-23)20(4,5)6;1-18(2,3)22-14-12-21(13-15-22)11-7-9-17(23)20-10-8-16-24-19(4,5)6;1-18(2,3)10-8-12-22-14-16-23-15-13-21-11-7-9-17(20)19(4,5)6;1-14(2,3)8-7-9-16-10-12-17(13-11-16)15(4,5)6;1-13(2,3)12(16)10-8-7-9-11-15-14(4,5)6;1-9(2)12-8-6-7-10(13)11(3,4)5;1-9(2,3)7-8-11-10(4,5)6;1-8(2)10-6-5-7-11-9(3)4/h8-18H2,1-7H3;18H,7-17H2,1-6H3;17-19H,7-16H2,1-6H3;7-17H2,1-6H3;7-16H2,1-6H3,(H,20,23);7-16H2,1-6H3;7-13H2,1-6H3;15H,7-11H2,1-6H3;9,12H,6-8H2,1-5H3;11H,7-8H2,1-6H3;8-10H,5-7H2,1-4H3.

What are the key properties of 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine?

8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine has a molecular weight of 3019.08 g/mol, XLogP of 35.68, 59 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(tert-butylamino)-2,2-dimethyloctan-3-one;N-tert-butyl-3,3-dimethylbutan-1-amine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]piperidine;1-(4-tert-butyl-4-methylpiperidin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;1-(4-tert-butylpiperazin-1-yl)-2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethanone;4-(4-tert-butylpiperazin-1-yl)-N-[3-[(2-methylpropan-2-yl)oxy]propyl]butanamide;4-(4-tert-butylpiperazin-1-yl)-1-(4-methyl-4-propan-2-ylpiperidin-1-yl)butan-1-one;6-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethoxy]-2,2-dimethylhexan-3-one;2,2-dimethyl-6-(propan-2-ylamino)hexan-3-one;N-propan-2-yl-3-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 167585345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).