6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine

C33H25Br2NO — CID 137423301

IUPAC6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine
SMILESCC1(C)c2ccc(Oc3cccc(Br)c3Br)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C33H25Br2NO/c1-33(2)28-19-17-25(37-31-15-9-14-30(34)32(31)35)21-27(28)26-18-16-24(20-29(26)33)36(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-21H,1-2H3
InChIKeyOKWHVCQBERHUAA-UHFFFAOYSA-N
MW611.38 g/mol
LogP10.78
Rot. Bonds5

About 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine

6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine (PubChem CID 137423301) has the molecular formula C33H25Br2NO and a molecular weight of 611.38 g/mol. Its IUPAC name is 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine.

Molecular Properties

Compound Name6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine
PubChem CID137423301
Molecular FormulaC33H25Br2NO
Molecular Weight611.38 g/mol
Exact Mass609.03
IUPAC Name6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine
SMILESCC1(C)c2ccc(Oc3cccc(Br)c3Br)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C33H25Br2NO/c1-33(2)28-19-17-25(37-31-15-9-14-30(34)32(31)35)21-27(28)26-18-16-24(20-29(26)33)36(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-21H,1-2H3
InChIKeyOKWHVCQBERHUAA-UHFFFAOYSA-N
XLogP10.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500611.38
LogP ≤ 510.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8,8,13,13-tetramethyl-5-N,5-N,16-N,16-N-tetraphenylhexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene-5,16-diamine
CID 59181773
[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenoxy]boronic acid
CID 142737900
2-N,2-N',7-N,7-N'-tetrakis(9,9-dimethylfluoren-2-yl)-2-N,2-N',7-N,7-N'-tetrakis(4-phenoxyphenyl)-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine
CID 153431611
10-(3-bromo-2-chlorophenoxy)-7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
CID 155397718
2-N-(9,9-dimethylfluoren-2-yl)-2-N-[4-(N-(3-methoxyphenyl)anilino)phenyl]-6-N,6-N-diphenylnaphthalene-2,6-diamine
CID 163509487
9,9-dimethyl-N,N-diphenylfluoren-3-amine
CID 126704960
N-[3-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 138498501
N,N-bis(4-methoxyphenyl)-9,9-dimethylfluoren-2-amine
CID 20734434
4-N-(9,9-dimethylfluoren-2-yl)-1-N,1-N-diphenyl-4-N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine
CID 59025126
2-N,7-N-bis[4-(3,5-diphenylphenyl)phenyl]-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine
CID 23561352
6-methoxy-9,9-dimethyl-N,N-bis(4-methylphenyl)fluoren-2-amine
CID 137436609
N-(9,9-dimethylfluoren-2-yl)-11,11-dimethyl-N-phenylbenzo[b]fluoren-7-amine
CID 156554324

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine?
The IUPAC name of 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine (CID 137423301) is 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine.
What is the SMILES notation for 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine?
The canonical SMILES for 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine is CC1(C)c2ccc(Oc3cccc(Br)c3Br)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine?
The InChIKey is OKWHVCQBERHUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H25Br2NO/c1-33(2)28-19-17-25(37-31-15-9-14-30(34)32(31)35)21-27(28)26-18-16-24(20-29(26)33)36(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-21H,1-2H3.
What are the key properties of 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine?
6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine has a molecular weight of 611.38 g/mol, XLogP of 10.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dibromophenoxy)-9,9-dimethyl-N,N-diphenylfluoren-2-amine is sourced from PubChem (CID 137423301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).