N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine

C33H35N — CID 156627621

IUPACN-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
SMILESCCc1c(N(c2ccccc2-c2ccccc2)C(C)(C)C)ccc2c1-c1ccccc1C2(C)C
InChIInChI=1S/C33H35N/c1-7-24-30(22-21-28-31(24)26-18-11-13-19-27(26)33(28,5)6)34(32(2,3)4)29-20-14-12-17-25(29)23-15-9-8-10-16-23/h8-22H,7H2,1-6H3
InChIKeyILTLXXNNDWMUNI-UHFFFAOYSA-N
MW445.65 g/mol
LogP9.16
Rot. Bonds4

About N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine

N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine (PubChem CID 156627621) has the molecular formula C33H35N and a molecular weight of 445.65 g/mol. Its IUPAC name is N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine.

Molecular Properties

Compound NameN-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
PubChem CID156627621
Molecular FormulaC33H35N
Molecular Weight445.65 g/mol
Exact Mass445.28
IUPAC NameN-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
SMILESCCc1c(N(c2ccccc2-c2ccccc2)C(C)(C)C)ccc2c1-c1ccccc1C2(C)C
InChIInChI=1S/C33H35N/c1-7-24-30(22-21-28-31(24)26-18-11-13-19-27(26)33(28,5)6)34(32(2,3)4)29-20-14-12-17-25(29)23-15-9-8-10-16-23/h8-22H,7H2,1-6H3
InChIKeyILTLXXNNDWMUNI-UHFFFAOYSA-N
XLogP9.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.65
LogP ≤ 59.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-4-ethyl-9,9-dimethyl-N-phenylfluoren-3-amine
CID 156627665
N-tert-butyl-4-(2-deuteriopropan-2-yl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
CID 156627533
N-tert-butyl-2-(1-deuterioethyl)-N-[2-(1-deuterioethyl)-3-phenylphenyl]-9,9-dimethylfluoren-1-amine
CID 156627564
9,9-dimethyl-4-phenylfluorene;ethane
CID 144938731
N-tert-butyl-2-(1-deuteriocyclohexyl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
CID 156627551
N-tert-butyl-1-(1-deuterioethyl)-9,9-dimethyl-N-(3-phenylphenyl)fluoren-2-amine
CID 156627701
9,9-dimethyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-4-amine
CID 90294553
9,9-dimethyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169020491
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-3-phenyl-N,2-bis(2-phenylphenyl)aniline
CID 168790921
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(4-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
CID 139355193
10,10,12,12-tetramethyl-N,5-diphenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-7-amine
CID 171402249
N-tert-butyl-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4-phenylaniline
CID 177100109

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine?
The IUPAC name of N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine (CID 156627621) is N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine.
What is the SMILES notation for N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine?
The canonical SMILES for N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine is CCc1c(N(c2ccccc2-c2ccccc2)C(C)(C)C)ccc2c1-c1ccccc1C2(C)C.
What is the InChIKey of N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine?
The InChIKey is ILTLXXNNDWMUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H35N/c1-7-24-30(22-21-28-31(24)26-18-11-13-19-27(26)33(28,5)6)34(32(2,3)4)29-20-14-12-17-25(29)23-15-9-8-10-16-23/h8-22H,7H2,1-6H3.
What are the key properties of N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine?
N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine has a molecular weight of 445.65 g/mol, XLogP of 9.16, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-ethyl-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine is sourced from PubChem (CID 156627621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).