7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine

C29H26BrN — CID 18694816

IUPAC7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine
SMILESCCC1(CC)c2cc(Br)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C29H26BrN/c1-3-29(4-2)27-19-21(30)15-17-25(27)26-18-16-24(20-28(26)29)31(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-20H,3-4H2,1-2H3
InChIKeyXDPFWKUUFXZLMK-UHFFFAOYSA-N
MW468.44 g/mol
LogP9.01
Rot. Bonds5

About 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine

7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine (PubChem CID 18694816) has the molecular formula C29H26BrN and a molecular weight of 468.44 g/mol. Its IUPAC name is 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine.

Molecular Properties

Compound Name7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine
PubChem CID18694816
Molecular FormulaC29H26BrN
Molecular Weight468.44 g/mol
Exact Mass467.12
IUPAC Name7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine
SMILESCCC1(CC)c2cc(Br)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C29H26BrN/c1-3-29(4-2)27-19-21(30)15-17-25(27)26-18-16-24(20-28(26)29)31(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-20H,3-4H2,1-2H3
InChIKeyXDPFWKUUFXZLMK-UHFFFAOYSA-N
XLogP9.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.44
LogP ≤ 59.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

24-bromo-9,9,18,18,27,27-hexaethyl-6-N,6-N,15-N,15-N-tetraphenylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3(8),4,6,10,12(17),13,15,19,21(26),22,24-dodecaene-6,15-diamine
CID 23650746
2-N,2-N,7-N-tris(9,9-diethylfluoren-2-yl)-9,9-diethyl-7-N-phenylfluorene-2,7-diamine
CID 23561815
2-N',2-N',7-N',7-N'-tetrakis(9,9-diethylfluoren-2-yl)-2-N,2-N,7-N,7-N-tetraphenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine
CID 121276321
7-[(E)-2-[7-[(E)-2-[9,9-diethyl-7-(N-phenylanilino)fluoren-2-yl]ethenyl]-9,9-diethylfluoren-2-yl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 101497253
7-bromo-N,N,9,9-tetraphenylfluoren-2-amine
CID 118632342
[9,9-diethyl-7-(N-phenylanilino)fluoren-2-yl]boronic acid
CID 67039823
2-N,7-N-bis(4-bromophenyl)-9,9-dioctyl-2-N,7-N-diphenylfluorene-2,7-diamine
CID 59533074
6-bromo-9,9,10,10-tetramethyl-N,N-diphenylanthracen-2-amine
CID 153445557
N-(9,9-diethylfluoren-2-yl)-11,11-diethyl-N-phenylbenzo[b]fluoren-3-amine
CID 177080014
7-[7-[7-[7-bromo-9,9-bis(3-methylbutyl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-bis(3-methylbutyl)fluoren-2-yl]-9,9-bis(3-methylbutyl)-N,N-diphenylfluoren-2-amine
CID 59348451
N,N-bis(3,4-dimethylphenyl)-9,9-diethylfluoren-2-amine
CID 20685715
7-[7-[9,9-diethyl-7-(4-methyl-N-(4-methylphenyl)anilino)fluoren-2-yl]-9,9-diethylfluoren-2-yl]-9,9-diethyl-N,N-bis(4-methylphenyl)fluoren-2-amine
CID 118424877

Frequently Asked Questions

What is the IUPAC name of 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine?
The IUPAC name of 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine (CID 18694816) is 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine.
What is the SMILES notation for 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine?
The canonical SMILES for 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine is CCC1(CC)c2cc(Br)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine?
The InChIKey is XDPFWKUUFXZLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26BrN/c1-3-29(4-2)27-19-21(30)15-17-25(27)26-18-16-24(20-28(26)29)31(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-20H,3-4H2,1-2H3.
What are the key properties of 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine?
7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine has a molecular weight of 468.44 g/mol, XLogP of 9.01, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-9,9-diethyl-N,N-diphenylfluoren-2-amine is sourced from PubChem (CID 18694816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).