1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane

C162H286N18O4 — CID 160903895

About 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane

1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane (PubChem CID 160903895) has the molecular formula C162H286N18O4 and a molecular weight of 2550.19 g/mol. Its IUPAC name is 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane.

Molecular Properties

• Compound Name: 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
• PubChem CID: 160903895
• Molecular Formula: C162H286N18O4
• Molecular Weight: 2550.19 g/mol
• Exact Mass: 2548.27
• IUPAC Name: 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
• SMILES: C.CC(=O)N1CCC(NC(C)(C)C)CC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCN(CC(c2ccccc2)c2ccccc2)CC1.CC(C)(C)NC1CCN(CC2Cc3ccccc3O2)CC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCCC1C=CCCC1.CC(C)CCCC(C)NC(C)(C)C.CC(CN1CCC(NC(C)(C)C)CC1)c1ccccc1.CN(C)c1ccc(CN2CCC(NC(C)(C)C)CC2)cc1.COc1ccc(CN2CCC(NC(C)(C)C)CC2)cc1.COc1ccc(NC(C)(C)C)cc1
• InChI: InChI=1S/C23H32N2.C18H31N3.C18H28N2O.C18H30N2.C17H28N2O.C12H23N.C12H27N.C11H22N2O.C11H17NO.C11H23N.C10H21N.CH4/c1-23(2,3)24-21-14-16-25(17-15-21)18-22(19-10-6-4-7-11-19)20-12-8-5-9-13-20;1-18(2,3)19-16-10-12-21(13-11-16)14-15-6-8-17(9-7-15)20(4)5;1-18(2,3)19-15-8-10-20(11-9-15)13-16-12-14-6-4-5-7-17(14)21-16;1-15(16-8-6-5-7-9-16)14-20-12-10-17(11-13-20)19-18(2,3)4;1-17(2,3)18-15-9-11-19(12-10-15)13-14-5-7-16(20-4)8-6-14;1-12(2,3)13-10-9-11-7-5-4-6-8-11;1-10(2)8-7-9-11(3)13-12(4,5)6;1-9(14)13-7-5-10(6-8-13)12-11(2,3)4;1-11(2,3)12-9-5-7-10(13-4)8-6-9;1-11(2,3)12-9-10-7-5-4-6-8-10;1-10(2,3)11-9-7-5-4-6-8-9;/h4-13,21-22,24H,14-18H2,1-3H3;6-9,16,19H,10-14H2,1-5H3;4-7,15-16,19H,8-13H2,1-3H3;5-9,15,17,19H,10-14H2,1-4H3;5-8,15,18H,9-13H2,1-4H3;5,7,11,13H,4,6,8-10H2,1-3H3;10-11,13H,7-9H2,1-6H3;10,12H,5-8H2,1-4H3;5-8,12H,1-4H3;10,12H,4-9H2,1-3H3;9,11H,4-8H2,1-3H3;1H4
• InChIKey: SPWHGUPDZHODHA-UHFFFAOYSA-N
• XLogP: 34.61
• TPSA: 199.77 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 21
• Rotatable Bonds: 34
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2550.19
LogP ≤ 5	34.61
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?

The IUPAC name of 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane (CID 160903895) is 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane.

What is the SMILES notation for 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?

The canonical SMILES for 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane is C.CC(=O)N1CCC(NC(C)(C)C)CC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCN(CC(c2ccccc2)c2ccccc2)CC1.CC(C)(C)NC1CCN(CC2Cc3ccccc3O2)CC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCCC1C=CCCC1.CC(C)CCCC(C)NC(C)(C)C.CC(CN1CCC(NC(C)(C)C)CC1)c1ccccc1.CN(C)c1ccc(CN2CCC(NC(C)(C)C)CC2)cc1.COc1ccc(CN2CCC(NC(C)(C)C)CC2)cc1.COc1ccc(NC(C)(C)C)cc1.

What is the InChIKey of 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?

The InChIKey is SPWHGUPDZHODHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2.C18H31N3.C18H28N2O.C18H30N2.C17H28N2O.C12H23N.C12H27N.C11H22N2O.C11H17NO.C11H23N.C10H21N.CH4/c1-23(2,3)24-21-14-16-25(17-15-21)18-22(19-10-6-4-7-11-19)20-12-8-5-9-13-20;1-18(2,3)19-16-10-12-21(13-11-16)14-15-6-8-17(9-7-15)20(4)5;1-18(2,3)19-15-8-10-20(11-9-15)13-16-12-14-6-4-5-7-17(14)21-16;1-15(16-8-6-5-7-9-16)14-20-12-10-17(11-13-20)19-18(2,3)4;1-17(2,3)18-15-9-11-19(12-10-15)13-14-5-7-16(20-4)8-6-14;1-12(2,3)13-10-9-11-7-5-4-6-8-11;1-10(2)8-7-9-11(3)13-12(4,5)6;1-9(14)13-7-5-10(6-8-13)12-11(2,3)4;1-11(2,3)12-9-5-7-10(13-4)8-6-9;1-11(2,3)12-9-10-7-5-4-6-8-10;1-10(2,3)11-9-7-5-4-6-8-9;/h4-13,21-22,24H,14-18H2,1-3H3;6-9,16,19H,10-14H2,1-5H3;4-7,15-16,19H,8-13H2,1-3H3;5-9,15,17,19H,10-14H2,1-4H3;5-8,15,18H,9-13H2,1-4H3;5,7,11,13H,4,6,8-10H2,1-3H3;10-11,13H,7-9H2,1-6H3;10,12H,5-8H2,1-4H3;5-8,12H,1-4H3;10,12H,4-9H2,1-3H3;9,11H,4-8H2,1-3H3;1H4.

What are the key properties of 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?

1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane has a molecular weight of 2550.19 g/mol, XLogP of 34.61, 34 rotatable bonds, 11 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-(tert-butylamino)piperidin-1-yl]ethanone;N-tert-butylcyclohexanamine;N-tert-butyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)piperidin-4-amine;N-tert-butyl-1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-amine;N-tert-butyl-1-(2,2-diphenylethyl)piperidin-4-amine;N-tert-butyl-4-methoxyaniline;N-tert-butyl-1-[(4-methoxyphenyl)methyl]piperidin-4-amine;N-tert-butyl-6-methylheptan-2-amine;N-tert-butyl-1-(2-phenylpropyl)piperidin-4-amine;N-(2-cyclohex-2-en-1-ylethyl)-2-methylpropan-2-amine;N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane is sourced from PubChem (CID 160903895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).