N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine

C113H175N3O3Si3 — CID 162279140

About N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine

N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine (PubChem CID 162279140) has the molecular formula C113H175N3O3Si3 and a molecular weight of 1707.92 g/mol. Its IUPAC name is N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine.

Molecular Properties

• Compound Name: N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine
• PubChem CID: 162279140
• Molecular Formula: C113H175N3O3Si3
• Molecular Weight: 1707.92 g/mol
• Exact Mass: 1706.29
• IUPAC Name: N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine
• SMILES: CC(C)(C)c1ccc(Oc2ccc3c(c2)C(C)(C)C2=CC4C(C=C23)CCC4[Si](C)(C)N(C(C)(C)C)C(C)(C)C)cc1.CCCCC1(CCCC)C2=CC3C(C=C2c2ccc(OC)cc21)CC(C)C3[Si](C)(C)N(C1CCCCC1)C(C)(C)C.CCCCC1(CCCC)C2=CC3C(C=C2c2ccc(OC)cc21)CCC3[Si](C)(C)N(C1CCCCC1)C(C)(C)C
• InChI: InChI=1S/C38H55NOSi.C38H61NOSi.C37H59NOSi/c1-35(2,3)26-15-17-27(18-16-26)40-28-19-20-29-31-22-25-14-21-34(30(25)24-33(31)38(10,11)32(29)23-28)41(12,13)39(36(4,5)6)37(7,8)9;1-10-12-21-38(22-13-11-2)34-25-30(40-7)19-20-31(34)33-24-28-23-27(3)36(32(28)26-35(33)38)41(8,9)39(37(4,5)6)29-17-15-14-16-18-29;1-9-11-22-37(23-12-10-2)33-25-29(39-6)19-20-30(33)32-24-27-18-21-35(31(27)26-34(32)37)40(7,8)38(36(3,4)5)28-16-14-13-15-17-28/h15-20,22-25,30,34H,14,21H2,1-13H3;19-20,24-29,32,36H,10-18,21-23H2,1-9H3;19-20,24-28,31,35H,9-18,21-23H2,1-8H3
• InChIKey: XQTAPSSRHFPTGO-UHFFFAOYSA-N
• XLogP: 32.51
• TPSA: 37.41 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 24
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1707.92
LogP ≤ 5	32.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine?

The IUPAC name of N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine (CID 162279140) is N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine.

What is the SMILES notation for N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine?

The canonical SMILES for N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine is CC(C)(C)c1ccc(Oc2ccc3c(c2)C(C)(C)C2=CC4C(C=C23)CCC4[Si](C)(C)N(C(C)(C)C)C(C)(C)C)cc1.CCCCC1(CCCC)C2=CC3C(C=C2c2ccc(OC)cc21)CC(C)C3[Si](C)(C)N(C1CCCCC1)C(C)(C)C.CCCCC1(CCCC)C2=CC3C(C=C2c2ccc(OC)cc21)CCC3[Si](C)(C)N(C1CCCCC1)C(C)(C)C.

What is the InChIKey of N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine?

The InChIKey is XQTAPSSRHFPTGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H55NOSi.C38H61NOSi.C37H59NOSi/c1-35(2,3)26-15-17-27(18-16-26)40-28-19-20-29-31-22-25-14-21-34(30(25)24-33(31)38(10,11)32(29)23-28)41(12,13)39(36(4,5)6)37(7,8)9;1-10-12-21-38(22-13-11-2)34-25-30(40-7)19-20-31(34)33-24-28-23-27(3)36(32(28)26-35(33)38)41(8,9)39(37(4,5)6)29-17-15-14-16-18-29;1-9-11-22-37(23-12-10-2)33-25-29(39-6)19-20-30(33)32-24-27-18-21-35(31(27)26-34(32)37)40(7,8)38(36(3,4)5)28-16-14-13-15-17-28/h15-20,22-25,30,34H,14,21H2,1-13H3;19-20,24-29,32,36H,10-18,21-23H2,1-9H3;19-20,24-28,31,35H,9-18,21-23H2,1-8H3.

What are the key properties of N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine?

N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine has a molecular weight of 1707.92 g/mol, XLogP of 32.51, 24 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-N-[[7-(4-tert-butylphenoxy)-9,9-dimethyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl]-dimethylsilyl]-2-methylpropan-2-amine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine;N-tert-butyl-N-[(9,9-dibutyl-7-methoxy-2-methyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b]fluoren-1-yl)-dimethylsilyl]cyclohexanamine is sourced from PubChem (CID 162279140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).