N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine

C33H41N — CID 156627501

IUPACN-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine
SMILESCc1ccccc1N(c1cc2c(cc1C)C(C)(C)c1cccc(C3CCCCC3)c1-2)C(C)(C)C
InChIInChI=1S/C33H41N/c1-22-14-11-12-19-29(22)34(32(3,4)5)30-21-26-28(20-23(30)2)33(6,7)27-18-13-17-25(31(26)27)24-15-9-8-10-16-24/h11-14,17-21,24H,8-10,15-16H2,1-7H3
InChIKeyIZZUEOMNXOCAJA-UHFFFAOYSA-N
MW451.70 g/mol
LogP9.59
Rot. Bonds3

About N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine

N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine (PubChem CID 156627501) has the molecular formula C33H41N and a molecular weight of 451.70 g/mol. Its IUPAC name is N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine.

Molecular Properties

Compound NameN-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine
PubChem CID156627501
Molecular FormulaC33H41N
Molecular Weight451.70 g/mol
Exact Mass451.32
IUPAC NameN-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine
SMILESCc1ccccc1N(c1cc2c(cc1C)C(C)(C)c1cccc(C3CCCCC3)c1-2)C(C)(C)C
InChIInChI=1S/C33H41N/c1-22-14-11-12-19-29(22)34(32(3,4)5)30-21-26-28(20-23(30)2)33(6,7)27-18-13-17-25(31(26)27)24-15-9-8-10-16-24/h11-14,17-21,24H,8-10,15-16H2,1-7H3
InChIKeyIZZUEOMNXOCAJA-UHFFFAOYSA-N
XLogP9.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.70
LogP ≤ 59.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-3-(4,4-dimethylcyclohexyl)-N-[2-(4,4-dimethylcyclohexyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 156627749
N-tert-butyl-2-(1-deuteriocyclohexyl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
CID 156627551
N-tert-butyl-2-(1-deuteriocyclohexyl)-N-[2-(1-deuteriocyclohexyl)-5-phenylphenyl]-9,9-dimethylfluoren-3-amine
CID 156627708
N-tert-butyl-7-cyclohexyl-3,9,9-trimethyl-N-(2-methyl-5-phenylphenyl)fluoren-2-amine;N-tert-butyl-7-fluoro-3,9,9-trimethyl-N-(2-methyl-5-phenylphenyl)fluoren-2-amine;N-tert-butyl-3,9,9-trimethyl-N-(2-methyl-5-phenylphenyl)-7-phenylfluoren-2-amine
CID 158169336
N-tert-butyl-2-cyclohexyl-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine;N-tert-butyl-2-cyclopentyl-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine;N-tert-butyl-2-cyclopropyl-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine;N,2-ditert-butyl-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine
CID 158201898
N-[3-tert-butyl-5-[3-tert-butyl-5-(3,5-ditert-butylphenyl)phenyl]phenyl]-N-(2-cyclohexylphenyl)-9,9-dimethylfluoren-2-amine
CID 160916569
1-N,6-N-bis(5-cyclohexyl-2,9,9-trimethylfluoren-3-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)pyrene-1,6-diamine;5-cyclohexyl-2,9,9-trimethyl-3-[(2-methyl-5-phenylphenyl)methyl]fluorene;3,8-dibromo-1H-pyren-1-ylium
CID 157065869
N-[4-(3-cyclohexylnaphthalen-2-yl)phenyl]-5,9,9-trimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 171740788
4-cyclohexyl-6-[30-(6-cyclohexyldibenzofuran-4-yl)-5,5,19,19,33,33-hexamethyl-8-nonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaenyl]dibenzofuran
CID 122519399
N-[2-(2-cyclohexylphenyl)phenyl]-N-[4-(2,6-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168771699
N-[2-(8-cyclohexylnaphthalen-1-yl)phenyl]-2-(9,9-dimethylfluoren-4-yl)-N-(2-naphthalen-1-ylphenyl)aniline
CID 170303604
N-[2-(8-cyclohexylnaphthalen-1-yl)phenyl]-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]naphthalen-1-amine
CID 170303584

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine?
The IUPAC name of N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine (CID 156627501) is N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine.
What is the SMILES notation for N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine?
The canonical SMILES for N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine is Cc1ccccc1N(c1cc2c(cc1C)C(C)(C)c1cccc(C3CCCCC3)c1-2)C(C)(C)C.
What is the InChIKey of N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine?
The InChIKey is IZZUEOMNXOCAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H41N/c1-22-14-11-12-19-29(22)34(32(3,4)5)30-21-26-28(20-23(30)2)33(6,7)27-18-13-17-25(31(26)27)24-15-9-8-10-16-24/h11-14,17-21,24H,8-10,15-16H2,1-7H3.
What are the key properties of N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine?
N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine has a molecular weight of 451.70 g/mol, XLogP of 9.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-5-cyclohexyl-2,9,9-trimethyl-N-(2-methylphenyl)fluoren-3-amine is sourced from PubChem (CID 156627501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).