N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine

C41H35N — CID 121285801

IUPACN-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
SMILESCc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2ccccc2)cc1)c1cccc2c1C(C)(C)c1ccccc1-2
InChIInChI=1S/C41H35N/c1-28-26-33(31-16-9-6-10-17-31)27-29(2)40(28)42(34-24-22-32(23-25-34)30-14-7-5-8-15-30)38-21-13-19-36-35-18-11-12-20-37(35)41(3,4)39(36)38/h5-27H,1-4H3
InChIKeyGAVNUCBMIRWHEW-UHFFFAOYSA-N
MW541.74 g/mol
LogP11.41
Rot. Bonds5

About N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine

N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine (PubChem CID 121285801) has the molecular formula C41H35N and a molecular weight of 541.74 g/mol. Its IUPAC name is N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine.

Molecular Properties

Compound NameN-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
PubChem CID121285801
Molecular FormulaC41H35N
Molecular Weight541.74 g/mol
Exact Mass541.28
IUPAC NameN-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
SMILESCc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2ccccc2)cc1)c1cccc2c1C(C)(C)c1ccccc1-2
InChIInChI=1S/C41H35N/c1-28-26-33(31-16-9-6-10-17-31)27-29(2)40(28)42(34-24-22-32(23-25-34)30-14-7-5-8-15-30)38-21-13-19-36-35-18-11-12-20-37(35)41(3,4)39(36)38/h5-27H,1-4H3
InChIKeyGAVNUCBMIRWHEW-UHFFFAOYSA-N
XLogP11.41
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500541.74
LogP ≤ 511.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-N-[2-methyl-4-[3-methyl-2-(2-methylphenyl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-1-amine
CID 145082585
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine;N-(2,6-dimethyl-4-phenylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;methane
CID 159092939
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(3-phenylphenyl)phenyl]fluoren-1-amine
CID 167285584
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-1-amine
CID 167285354
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
CID 121285751
4-[3,5-dimethyl-4-[N-(2-phenylphenyl)-4-(3-phenylphenyl)anilino]phenyl]-2,6-dimethyl-N-(2-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 121322868
2-(9,9-dimethylfluoren-1-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]aniline
CID 170218393
N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-1-amine
CID 170215738
9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-1-amine;N-[4-(3,5-diphenylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine
CID 167649293
N-(9,9-dimethylfluoren-2-yl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9'-spirobi[fluorene]-1-amine
CID 168750038
N-[4-[4-[4-[4-[(9,9-dimethylfluoren-2-yl)-(9,9'-spirobi[fluorene]-1-yl)amino]phenyl]phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine
CID 155005492
N-[2,6-dimethyl-4-(2-phenylphenyl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155221215

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The IUPAC name of N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine (CID 121285801) is N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine.
What is the SMILES notation for N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The canonical SMILES for N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine is Cc1cc(-c2ccccc2)cc(C)c1N(c1ccc(-c2ccccc2)cc1)c1cccc2c1C(C)(C)c1ccccc1-2.
What is the InChIKey of N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The InChIKey is GAVNUCBMIRWHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H35N/c1-28-26-33(31-16-9-6-10-17-31)27-29(2)40(28)42(34-24-22-32(23-25-34)30-14-7-5-8-15-30)38-21-13-19-36-35-18-11-12-20-37(35)41(3,4)39(36)38/h5-27H,1-4H3.
What are the key properties of N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine has a molecular weight of 541.74 g/mol, XLogP of 11.41, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethyl-4-phenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine is sourced from PubChem (CID 121285801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).