4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one

C136H214N24O5 — CID 158835705

About 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one

4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one (PubChem CID 158835705) has the molecular formula C136H214N24O5 and a molecular weight of 2265.37 g/mol. Its IUPAC name is 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one.

Molecular Properties

• Compound Name: 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one
• PubChem CID: 158835705
• Molecular Formula: C136H214N24O5
• Molecular Weight: 2265.37 g/mol
• Exact Mass: 2263.72
• IUPAC Name: 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one
• SMILES: CC(C)(C)C(=O)N1CCC(Cc2cc(C(C)(C)C)ncn2)CC1.CC(C)(C)c1cc(NC2COC2)nc(N2CCCCC2)n1.CC(C)(C)c1ccnc(Cc2ccncc2)c1.CC(C)C(=O)N1CC(Cc2cc(C(C)(C)C)ncn2)C1.CC(C)CC(=O)N1CCC(Cc2cc(C(C)(C)C)ncn2)CC1.CCCC(=O)N1CC(Cc2cc(C(C)(C)C)ncn2)C1.CN1CCCCC1CCc1cc(C(C)(C)C)ccn1.CN1CCN(c2cc(C(C)(C)C)cc(NC3CCC3)n2)CC1
• InChI: InChI=1S/2C19H31N3O.C18H30N4.C17H28N2.C16H26N4O.2C16H25N3O.C15H18N2/c1-18(2,3)16-12-15(20-13-21-16)11-14-7-9-22(10-8-14)17(23)19(4,5)6;1-14(2)10-18(23)22-8-6-15(7-9-22)11-16-12-17(19(3,4)5)21-13-20-16;1-18(2,3)14-12-16(19-15-6-5-7-15)20-17(13-14)22-10-8-21(4)9-11-22;1-17(2,3)14-10-11-18-15(13-14)8-9-16-7-5-6-12-19(16)4;1-16(2,3)13-9-14(17-12-10-21-11-12)19-15(18-13)20-7-5-4-6-8-20;1-11(2)15(20)19-8-12(9-19)6-13-7-14(16(3,4)5)18-10-17-13;1-5-6-15(20)19-9-12(10-19)7-13-8-14(16(2,3)4)18-11-17-13;1-15(2,3)13-6-9-17-14(11-13)10-12-4-7-16-8-5-12/h12-14H,7-11H2,1-6H3;12-15H,6-11H2,1-5H3;12-13,15H,5-11H2,1-4H3,(H,19,20);10-11,13,16H,5-9,12H2,1-4H3;9,12H,4-8,10-11H2,1-3H3,(H,17,18,19);7,10-12H,6,8-9H2,1-5H3;8,11-12H,5-7,9-10H2,1-4H3;4-9,11H,10H2,1-3H3
• InChIKey: IXPJBVXABIMGDI-UHFFFAOYSA-N
• XLogP: 25.04
• TPSA: 307.95 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 25
• Rotatable Bonds: 24
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2265.37
LogP ≤ 5	25.04
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one?

The IUPAC name of 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one (CID 158835705) is 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one.

What is the SMILES notation for 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one?

The canonical SMILES for 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one is CC(C)(C)C(=O)N1CCC(Cc2cc(C(C)(C)C)ncn2)CC1.CC(C)(C)c1cc(NC2COC2)nc(N2CCCCC2)n1.CC(C)(C)c1ccnc(Cc2ccncc2)c1.CC(C)C(=O)N1CC(Cc2cc(C(C)(C)C)ncn2)C1.CC(C)CC(=O)N1CCC(Cc2cc(C(C)(C)C)ncn2)CC1.CCCC(=O)N1CC(Cc2cc(C(C)(C)C)ncn2)C1.CN1CCCCC1CCc1cc(C(C)(C)C)ccn1.CN1CCN(c2cc(C(C)(C)C)cc(NC3CCC3)n2)CC1.

What is the InChIKey of 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one?

The InChIKey is IXPJBVXABIMGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H31N3O.C18H30N4.C17H28N2.C16H26N4O.2C16H25N3O.C15H18N2/c1-18(2,3)16-12-15(20-13-21-16)11-14-7-9-22(10-8-14)17(23)19(4,5)6;1-14(2)10-18(23)22-8-6-15(7-9-22)11-16-12-17(19(3,4)5)21-13-20-16;1-18(2,3)14-12-16(19-15-6-5-7-15)20-17(13-14)22-10-8-21(4)9-11-22;1-17(2,3)14-10-11-18-15(13-14)8-9-16-7-5-6-12-19(16)4;1-16(2,3)13-9-14(17-12-10-21-11-12)19-15(18-13)20-7-5-4-6-8-20;1-11(2)15(20)19-8-12(9-19)6-13-7-14(16(3,4)5)18-10-17-13;1-5-6-15(20)19-9-12(10-19)7-13-8-14(16(2,3)4)18-11-17-13;1-15(2,3)13-6-9-17-14(11-13)10-12-4-7-16-8-5-12/h12-14H,7-11H2,1-6H3;12-15H,6-11H2,1-5H3;12-13,15H,5-11H2,1-4H3,(H,19,20);10-11,13,16H,5-9,12H2,1-4H3;9,12H,4-8,10-11H2,1-3H3,(H,17,18,19);7,10-12H,6,8-9H2,1-5H3;8,11-12H,5-7,9-10H2,1-4H3;4-9,11H,10H2,1-3H3.

What are the key properties of 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one?

4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one has a molecular weight of 2265.37 g/mol, XLogP of 25.04, 24 rotatable bonds, 2 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one is sourced from PubChem (CID 158835705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).