N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine

C129H153N3 — CID 159578288

IUPACN-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine
SMILESCC(C)N(c1ccc(-c2ccccc2)cc1C1CCC(C)(C)CC1)c1cc2c(cc1C1CCC(C)(C)CC1)-c1ccccc1C2(C)C.CC(C)N(c1ccc(-c2ccccc2)cc1C1CCCC1)c1cc2c(cc1C1CCCC1)-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2cc(C3CCCCC3)c(N(c3ccc(-c4ccccc4)cc3C3CCCCC3)C(C)(C)C)cc21
InChIInChI=1S/C46H57N.C43H51N.C40H45N/c1-31(2)47(42-19-18-35(32-14-10-9-11-15-32)28-37(42)33-20-24-44(3,4)25-21-33)43-30-41-39(36-16-12-13-17-40(36)46(41,7)8)29-38(43)34-22-26-45(5,6)27-23-34;1-42(2,3)44(40-26-25-33(30-17-9-6-10-18-30)27-35(40)31-19-11-7-12-20-31)41-29-39-37(28-36(41)32-21-13-8-14-22-32)34-23-15-16-24-38(34)43(39,4)5;1-27(2)41(38-23-22-31(28-14-6-5-7-15-28)24-33(38)29-16-8-9-17-29)39-26-37-35(25-34(39)30-18-10-11-19-30)32-20-12-13-21-36(32)40(37,3)4/h9-19,28-31,33-34H,20-27H2,1-8H3;6,9-10,15-18,23-29,31-32H,7-8,11-14,19-22H2,1-5H3;5-7,12-15,20-27,29-30H,8-11,16-19H2,1-4H3
InChIKeyMIRLGIBIMIRMEI-UHFFFAOYSA-N
MW1745.66 g/mol
LogP37.79
Rot. Bonds17

About N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine

N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine (PubChem CID 159578288) has the molecular formula C129H153N3 and a molecular weight of 1745.66 g/mol. Its IUPAC name is N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine.

Molecular Properties

Compound NameN-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine
PubChem CID159578288
Molecular FormulaC129H153N3
Molecular Weight1745.66 g/mol
Exact Mass1744.21
IUPAC NameN-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine
SMILESCC(C)N(c1ccc(-c2ccccc2)cc1C1CCC(C)(C)CC1)c1cc2c(cc1C1CCC(C)(C)CC1)-c1ccccc1C2(C)C.CC(C)N(c1ccc(-c2ccccc2)cc1C1CCCC1)c1cc2c(cc1C1CCCC1)-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2cc(C3CCCCC3)c(N(c3ccc(-c4ccccc4)cc3C3CCCCC3)C(C)(C)C)cc21
InChIInChI=1S/C46H57N.C43H51N.C40H45N/c1-31(2)47(42-19-18-35(32-14-10-9-11-15-32)28-37(42)33-20-24-44(3,4)25-21-33)43-30-41-39(36-16-12-13-17-40(36)46(41,7)8)29-38(43)34-22-26-45(5,6)27-23-34;1-42(2,3)44(40-26-25-33(30-17-9-6-10-18-30)27-35(40)31-19-11-7-12-20-31)41-29-39-37(28-36(41)32-21-13-8-14-22-32)34-23-15-16-24-38(34)43(39,4)5;1-27(2)41(38-23-22-31(28-14-6-5-7-15-28)24-33(38)29-16-8-9-17-29)39-26-37-35(25-34(39)30-18-10-11-19-30)32-20-12-13-21-36(32)40(37,3)4/h9-19,28-31,33-34H,20-27H2,1-8H3;6,9-10,15-18,23-29,31-32H,7-8,11-14,19-22H2,1-5H3;5-7,12-15,20-27,29-30H,8-11,16-19H2,1-4H3
InChIKeyMIRLGIBIMIRMEI-UHFFFAOYSA-N
XLogP37.79
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms132
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001745.66
LogP ≤ 537.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine?
The IUPAC name of N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine (CID 159578288) is N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine.
What is the SMILES notation for N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine?
The canonical SMILES for N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine is CC(C)N(c1ccc(-c2ccccc2)cc1C1CCC(C)(C)CC1)c1cc2c(cc1C1CCC(C)(C)CC1)-c1ccccc1C2(C)C.CC(C)N(c1ccc(-c2ccccc2)cc1C1CCCC1)c1cc2c(cc1C1CCCC1)-c1ccccc1C2(C)C.CC1(C)c2ccccc2-c2cc(C3CCCCC3)c(N(c3ccc(-c4ccccc4)cc3C3CCCCC3)C(C)(C)C)cc21.
What is the InChIKey of N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine?
The InChIKey is MIRLGIBIMIRMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H57N.C43H51N.C40H45N/c1-31(2)47(42-19-18-35(32-14-10-9-11-15-32)28-37(42)33-20-24-44(3,4)25-21-33)43-30-41-39(36-16-12-13-17-40(36)46(41,7)8)29-38(43)34-22-26-45(5,6)27-23-34;1-42(2,3)44(40-26-25-33(30-17-9-6-10-18-30)27-35(40)31-19-11-7-12-20-31)41-29-39-37(28-36(41)32-21-13-8-14-22-32)34-23-15-16-24-38(34)43(39,4)5;1-27(2)41(38-23-22-31(28-14-6-5-7-15-28)24-33(38)29-16-8-9-17-29)39-26-37-35(25-34(39)30-18-10-11-19-30)32-20-12-13-21-36(32)40(37,3)4/h9-19,28-31,33-34H,20-27H2,1-8H3;6,9-10,15-18,23-29,31-32H,7-8,11-14,19-22H2,1-5H3;5-7,12-15,20-27,29-30H,8-11,16-19H2,1-4H3.
What are the key properties of N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine?
N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine has a molecular weight of 1745.66 g/mol, XLogP of 37.79, 17 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-cyclohexyl-N-(2-cyclohexyl-4-phenylphenyl)-9,9-dimethylfluoren-2-amine;3-cyclopentyl-N-(2-cyclopentyl-4-phenylphenyl)-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)-4-phenylphenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine is sourced from PubChem (CID 159578288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).