1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole

C140H262N15O7S3+ — CID 158037366

About 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole

1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole (PubChem CID 158037366) has the molecular formula C140H262N15O7S3+ and a molecular weight of 2363.93 g/mol. Its IUPAC name is 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole.

Molecular Properties

• Compound Name: 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole
• PubChem CID: 158037366
• Molecular Formula: C140H262N15O7S3+
• Molecular Weight: 2363.93 g/mol
• Exact Mass: 2361.98
• IUPAC Name: 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole
• SMILES: CC(=O)N1CCC(CCC(C)(C)C)CC1.CC(=O)N1CCC(OC(C)(C)C)CC1.CC(C)(C)CCc1ccccn1.CC(C)(C)N1CCCCC1.CC(C)(C)Oc1ccccn1.CC(C)(C)c1csc([N+]2=CCC=C2)n1.CC(C)c1cscn1.CCCN1CCC(CCC(C)(C)C)CC1.CCCN1CCC(CCC(C)(C)C)CC1.CCCN1CCC(OC(C)(C)C)CC1.CCCN1CCC(OC(C)C)CC1.CCCN1CCC(OC)CC1.CCN(CC)c1nc(C(C)C)cs1
• InChI: InChI=1S/2C14H29N.C13H25NO.C12H25NO.C11H15N2S.C11H21NO2.C11H23NO.C11H17N.C10H18N2S.C9H13NO.C9H19NO.C9H19N.C6H9NS/c2*1-5-10-15-11-7-13(8-12-15)6-9-14(2,3)4;1-11(15)14-9-6-12(7-10-14)5-8-13(2,3)4;1-5-8-13-9-6-11(7-10-13)14-12(2,3)4;1-11(2,3)9-8-14-10(12-9)13-6-4-5-7-13;1-9(13)12-7-5-10(6-8-12)14-11(2,3)4;1-4-7-12-8-5-11(6-9-12)13-10(2)3;1-11(2,3)8-7-10-6-4-5-9-12-10;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-9(2,3)11-8-6-4-5-7-10-8;1-3-6-10-7-4-9(11-2)5-8-10;1-9(2,3)10-7-5-4-6-8-10;1-5(2)6-3-8-4-7-6/h2*13H,5-12H2,1-4H3;12H,5-10H2,1-4H3;11H,5-10H2,1-4H3;4,6-8H,5H2,1-3H3;10H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;4-6,9H,7-8H2,1-3H3;7-8H,5-6H2,1-4H3;4-7H,1-3H3;9H,3-8H2,1-2H3;4-8H2,1-3H3;3-5H,1-2H3/q;;;;+1
• InChIKey: LURJMJDLQSCCJY-UHFFFAOYSA-N
• XLogP: 35.26
• TPSA: 176.91 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 30
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2363.93
LogP ≤ 5	35.26
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole?

The IUPAC name of 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole (CID 158037366) is 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole.

What is the SMILES notation for 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole?

The canonical SMILES for 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole is CC(=O)N1CCC(CCC(C)(C)C)CC1.CC(=O)N1CCC(OC(C)(C)C)CC1.CC(C)(C)CCc1ccccn1.CC(C)(C)N1CCCCC1.CC(C)(C)Oc1ccccn1.CC(C)(C)c1csc([N+]2=CCC=C2)n1.CC(C)c1cscn1.CCCN1CCC(CCC(C)(C)C)CC1.CCCN1CCC(CCC(C)(C)C)CC1.CCCN1CCC(OC(C)(C)C)CC1.CCCN1CCC(OC(C)C)CC1.CCCN1CCC(OC)CC1.CCN(CC)c1nc(C(C)C)cs1.

What is the InChIKey of 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole?

The InChIKey is LURJMJDLQSCCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H29N.C13H25NO.C12H25NO.C11H15N2S.C11H21NO2.C11H23NO.C11H17N.C10H18N2S.C9H13NO.C9H19NO.C9H19N.C6H9NS/c2*1-5-10-15-11-7-13(8-12-15)6-9-14(2,3)4;1-11(15)14-9-6-12(7-10-14)5-8-13(2,3)4;1-5-8-13-9-6-11(7-10-13)14-12(2,3)4;1-11(2,3)9-8-14-10(12-9)13-6-4-5-7-13;1-9(13)12-7-5-10(6-8-12)14-11(2,3)4;1-4-7-12-8-5-11(6-9-12)13-10(2)3;1-11(2,3)8-7-10-6-4-5-9-12-10;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-9(2,3)11-8-6-4-5-7-10-8;1-3-6-10-7-4-9(11-2)5-8-10;1-9(2,3)10-7-5-4-6-8-10;1-5(2)6-3-8-4-7-6/h2*13H,5-12H2,1-4H3;12H,5-10H2,1-4H3;11H,5-10H2,1-4H3;4,6-8H,5H2,1-3H3;10H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;4-6,9H,7-8H2,1-3H3;7-8H,5-6H2,1-4H3;4-7H,1-3H3;9H,3-8H2,1-2H3;4-8H2,1-3H3;3-5H,1-2H3/q;;;;+1;;;;;;;;.

What are the key properties of 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole?

1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole has a molecular weight of 2363.93 g/mol, XLogP of 35.26, 30 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 1-tert-butylpiperidine;4-tert-butyl-2-(3H-pyrrol-1-ium-1-yl)-1,3-thiazole;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;1-[4-(3,3-dimethylbutyl)piperidin-1-yl]ethanone;bis(4-(3,3-dimethylbutyl)-1-propylpiperidine);2-(3,3-dimethylbutyl)pyridine;4-methoxy-1-propylpiperidine;1-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethanone;4-[(2-methylpropan-2-yl)oxy]-1-propylpiperidine;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yloxy-1-propylpiperidine;4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 158037366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).