4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine

C138H218N10O4 — CID 162248367

IUPAC4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine
SMILESCC(C)(C)c1ccc(N2CC3CCC(C3)C2)cc1.CC(C)(C)c1ccc(N2CC3CCC2C3)cc1.CC1(C)CCCN(c2ccc(C(C)(C)C)cc2)C1.CC1CC(C)CN(c2ccc(C(C)(C)C)cc2)C1.CC1CN(CCNc2ccc(C(C)(C)C)cc2)CC(C)O1.CC1CN(c2ccc(C(C)(C)C)cc2)CC(C(C)(C)O)O1.CCCC1CN(c2ccc(C(C)(C)C)cc2)CCO1.CN(C)CC1CCCN(c2ccc(C(C)(C)C)cc2)C1
InChIInChI=1S/C18H30N2O.C18H30N2.C18H29NO2.C17H27NO.C17H25N.2C17H27N.C16H23N/c1-14-12-20(13-15(2)21-14)11-10-19-17-8-6-16(7-9-17)18(3,4)5;1-18(2,3)16-8-10-17(11-9-16)20-12-6-7-15(14-20)13-19(4)5;1-13-11-19(12-16(21-13)18(5,6)20)15-9-7-14(8-10-15)17(2,3)4;1-5-6-16-13-18(11-12-19-16)15-9-7-14(8-10-15)17(2,3)4;1-17(2,3)15-6-8-16(9-7-15)18-11-13-4-5-14(10-13)12-18;1-16(2,3)14-7-9-15(10-8-14)18-12-6-11-17(4,5)13-18;1-13-10-14(2)12-18(11-13)16-8-6-15(7-9-16)17(3,4)5;1-16(2,3)13-5-8-14(9-6-13)17-11-12-4-7-15(17)10-12/h6-9,14-15,19H,10-13H2,1-5H3;8-11,15H,6-7,12-14H2,1-5H3;7-10,13,16,20H,11-12H2,1-6H3;7-10,16H,5-6,11-13H2,1-4H3;6-9,13-14H,4-5,10-12H2,1-3H3;7-10H,6,11-13H2,1-5H3;6-9,13-14H,10-12H2,1-5H3;5-6,8-9,12,15H,4,7,10-11H2,1-3H3
InChIKeyZXQNWAKQFIBENU-UHFFFAOYSA-N
MW2081.33 g/mol
LogP31.88
Rot. Bonds16

About 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine

4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine (PubChem CID 162248367) has the molecular formula C138H218N10O4 and a molecular weight of 2081.33 g/mol. Its IUPAC name is 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine.

Molecular Properties

Compound Name4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine
PubChem CID162248367
Molecular FormulaC138H218N10O4
Molecular Weight2081.33 g/mol
Exact Mass2079.72
IUPAC Name4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine
SMILESCC(C)(C)c1ccc(N2CC3CCC(C3)C2)cc1.CC(C)(C)c1ccc(N2CC3CCC2C3)cc1.CC1(C)CCCN(c2ccc(C(C)(C)C)cc2)C1.CC1CC(C)CN(c2ccc(C(C)(C)C)cc2)C1.CC1CN(CCNc2ccc(C(C)(C)C)cc2)CC(C)O1.CC1CN(c2ccc(C(C)(C)C)cc2)CC(C(C)(C)O)O1.CCCC1CN(c2ccc(C(C)(C)C)cc2)CCO1.CN(C)CC1CCCN(c2ccc(C(C)(C)C)cc2)C1
InChIInChI=1S/C18H30N2O.C18H30N2.C18H29NO2.C17H27NO.C17H25N.2C17H27N.C16H23N/c1-14-12-20(13-15(2)21-14)11-10-19-17-8-6-16(7-9-17)18(3,4)5;1-18(2,3)16-8-10-17(11-9-16)20-12-6-7-15(14-20)13-19(4)5;1-13-11-19(12-16(21-13)18(5,6)20)15-9-7-14(8-10-15)17(2,3)4;1-5-6-16-13-18(11-12-19-16)15-9-7-14(8-10-15)17(2,3)4;1-17(2,3)15-6-8-16(9-7-15)18-11-13-4-5-14(10-13)12-18;1-16(2,3)14-7-9-15(10-8-14)18-12-6-11-17(4,5)13-18;1-13-10-14(2)12-18(11-13)16-8-6-15(7-9-16)17(3,4)5;1-16(2,3)13-5-8-14(9-6-13)17-11-12-4-7-15(17)10-12/h6-9,14-15,19H,10-13H2,1-5H3;8-11,15H,6-7,12-14H2,1-5H3;7-10,13,16,20H,11-12H2,1-6H3;7-10,16H,5-6,11-13H2,1-4H3;6-9,13-14H,4-5,10-12H2,1-3H3;7-10H,6,11-13H2,1-5H3;6-9,13-14H,10-12H2,1-5H3;5-6,8-9,12,15H,4,7,10-11H2,1-3H3
InChIKeyZXQNWAKQFIBENU-UHFFFAOYSA-N
XLogP31.88
TPSA89.11 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms152
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002081.33
LogP ≤ 531.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Analyze 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine?
The IUPAC name of 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine (CID 162248367) is 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine.
What is the SMILES notation for 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine?
The canonical SMILES for 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine is CC(C)(C)c1ccc(N2CC3CCC(C3)C2)cc1.CC(C)(C)c1ccc(N2CC3CCC2C3)cc1.CC1(C)CCCN(c2ccc(C(C)(C)C)cc2)C1.CC1CC(C)CN(c2ccc(C(C)(C)C)cc2)C1.CC1CN(CCNc2ccc(C(C)(C)C)cc2)CC(C)O1.CC1CN(c2ccc(C(C)(C)C)cc2)CC(C(C)(C)O)O1.CCCC1CN(c2ccc(C(C)(C)C)cc2)CCO1.CN(C)CC1CCCN(c2ccc(C(C)(C)C)cc2)C1.
What is the InChIKey of 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine?
The InChIKey is ZXQNWAKQFIBENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O.C18H30N2.C18H29NO2.C17H27NO.C17H25N.2C17H27N.C16H23N/c1-14-12-20(13-15(2)21-14)11-10-19-17-8-6-16(7-9-17)18(3,4)5;1-18(2,3)16-8-10-17(11-9-16)20-12-6-7-15(14-20)13-19(4)5;1-13-11-19(12-16(21-13)18(5,6)20)15-9-7-14(8-10-15)17(2,3)4;1-5-6-16-13-18(11-12-19-16)15-9-7-14(8-10-15)17(2,3)4;1-17(2,3)15-6-8-16(9-7-15)18-11-13-4-5-14(10-13)12-18;1-16(2,3)14-7-9-15(10-8-14)18-12-6-11-17(4,5)13-18;1-13-10-14(2)12-18(11-13)16-8-6-15(7-9-16)17(3,4)5;1-16(2,3)13-5-8-14(9-6-13)17-11-12-4-7-15(17)10-12/h6-9,14-15,19H,10-13H2,1-5H3;8-11,15H,6-7,12-14H2,1-5H3;7-10,13,16,20H,11-12H2,1-6H3;7-10,16H,5-6,11-13H2,1-4H3;6-9,13-14H,4-5,10-12H2,1-3H3;7-10H,6,11-13H2,1-5H3;6-9,13-14H,10-12H2,1-5H3;5-6,8-9,12,15H,4,7,10-11H2,1-3H3.
What are the key properties of 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine?
4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine has a molecular weight of 2081.33 g/mol, XLogP of 31.88, 16 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]aniline;2-(4-tert-butylphenyl)-2-azabicyclo[2.2.1]heptane;3-(4-tert-butylphenyl)-3-azabicyclo[3.2.1]octane;1-(4-tert-butylphenyl)-3,3-dimethylpiperidine;1-(4-tert-butylphenyl)-3,5-dimethylpiperidine;2-[4-(4-tert-butylphenyl)-6-methylmorpholin-2-yl]propan-2-ol;1-[1-(4-tert-butylphenyl)piperidin-3-yl]-N,N-dimethylmethanamine;4-(4-tert-butylphenyl)-2-propylmorpholine is sourced from PubChem (CID 162248367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).