1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine

C39H30N2 — CID 154697085

IUPAC1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(N(c4ccccc4)c4ccccc4)cc4c3[nH]c3ccccc34)cc21
InChIInChI=1S/C39H30N2/c1-39(2)35-19-11-9-17-30(35)31-22-21-26(23-36(31)39)33-24-29(25-34-32-18-10-12-20-37(32)40-38(33)34)41(27-13-5-3-6-14-27)28-15-7-4-8-16-28/h3-25,40H,1-2H3
InChIKeyATHNOZKIOAGAKW-UHFFFAOYSA-N
MW526.68 g/mol
LogP10.76
Rot. Bonds4

About 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine

1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine (PubChem CID 154697085) has the molecular formula C39H30N2 and a molecular weight of 526.68 g/mol. Its IUPAC name is 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine.

Molecular Properties

Compound Name1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine
PubChem CID154697085
Molecular FormulaC39H30N2
Molecular Weight526.68 g/mol
Exact Mass526.24
IUPAC Name1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(N(c4ccccc4)c4ccccc4)cc4c3[nH]c3ccccc34)cc21
InChIInChI=1S/C39H30N2/c1-39(2)35-19-11-9-17-30(35)31-22-21-26(23-36(31)39)33-24-29(25-34-32-18-10-12-20-37(32)40-38(33)34)41(27-13-5-3-6-14-27)28-15-7-4-8-16-28/h3-25,40H,1-2H3
InChIKeyATHNOZKIOAGAKW-UHFFFAOYSA-N
XLogP10.76
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.68
LogP ≤ 510.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[9,9-dimethyl-7-(N-phenylanilino)fluoren-2-yl]-N,N-diphenyl-9H-carbazol-3-amine
CID 154697182
1-dibenzothiophen-4-yl-N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9H-carbazol-3-amine
CID 154697176
N-[4-(9H-carbazol-3-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 59306861
2-(9,9-dimethylfluoren-2-yl)-9H-carbazole
CID 126651978
3,5-bis(9,9-dimethylfluoren-2-yl)-N-(4-methylphenyl)-N-phenylaniline
CID 58389731
7-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,9-dimethyl-N,N-diphenylfluoren-2-amine
CID 153018330
N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline
CID 59757697
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
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenanthren-9-yl-N-phenylfluoren-2-amine
CID 118500286
9,9-dimethyl-N-[4-(6-phenyl-9H-carbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 155383152
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-(4-phenylphenyl)aniline;4-(9,9-dimethylfluoren-2-yl)-N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,4-diphenylaniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-(2-phenylphenyl)-N,N-bis[4-(2-phenylphenyl)phenyl]aniline
CID 159257633

Frequently Asked Questions

What is the IUPAC name of 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine?
The IUPAC name of 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine (CID 154697085) is 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine.
What is the SMILES notation for 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine?
The canonical SMILES for 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine is CC1(C)c2ccccc2-c2ccc(-c3cc(N(c4ccccc4)c4ccccc4)cc4c3[nH]c3ccccc34)cc21.
What is the InChIKey of 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine?
The InChIKey is ATHNOZKIOAGAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H30N2/c1-39(2)35-19-11-9-17-30(35)31-22-21-26(23-36(31)39)33-24-29(25-34-32-18-10-12-20-37(32)40-38(33)34)41(27-13-5-3-6-14-27)28-15-7-4-8-16-28/h3-25,40H,1-2H3.
What are the key properties of 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine?
1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine has a molecular weight of 526.68 g/mol, XLogP of 10.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9,9-dimethylfluoren-2-yl)-N,N-diphenyl-9H-carbazol-3-amine is sourced from PubChem (CID 154697085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).