9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine

C35H39N — CID 86165804

IUPAC9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine
SMILESCCCCC1(CCCC)c2ccccc2-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc21
InChIInChI=1S/C35H39N/c1-5-7-23-35(24-8-6-2)33-12-10-9-11-31(33)32-22-21-30(25-34(32)35)36(28-17-13-26(3)14-18-28)29-19-15-27(4)16-20-29/h9-22,25H,5-8,23-24H2,1-4H3
InChIKeyHJDXFRFLWRWCJR-UHFFFAOYSA-N
MW473.70 g/mol
LogP10.42
Rot. Bonds9

About 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine

9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine (PubChem CID 86165804) has the molecular formula C35H39N and a molecular weight of 473.70 g/mol. Its IUPAC name is 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine
PubChem CID86165804
Molecular FormulaC35H39N
Molecular Weight473.70 g/mol
Exact Mass473.31
IUPAC Name9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine
SMILESCCCCC1(CCCC)c2ccccc2-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc21
InChIInChI=1S/C35H39N/c1-5-7-23-35(24-8-6-2)33-12-10-9-11-31(33)32-22-21-30(25-34(32)35)36(28-17-13-26(3)14-18-28)29-19-15-27(4)16-20-29/h9-22,25H,5-8,23-24H2,1-4H3
InChIKeyHJDXFRFLWRWCJR-UHFFFAOYSA-N
XLogP10.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.70
LogP ≤ 510.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-butyl-2-N,2-N,7-N,7-N-tetraphenyl-9-propylfluorene-2,7-diamine
CID 71228215
9,9-dibutyl-N-[6-[10-(9,9-dibutylfluoren-2-yl)anthracen-9-yl]naphthalen-2-yl]-N-(9,9-dibutyl-7-methylfluoren-2-yl)-7-methylfluoren-2-amine
CID 168837036
9,9-dibutyl-7-[(E)-2-[4-[(E)-2-(9,9-dibutylfluoren-2-yl)ethenyl]phenyl]ethenyl]-N,N-diphenylfluoren-2-amine
CID 101407197
N-(9,9-dihexylfluoren-2-yl)-9,9-dihexyl-N,7-dimethylfluoren-2-amine
CID 58151400
N-[4-(7-butan-2-yl-9,9-dioctylfluoren-2-yl)phenyl]-N-(4-methylphenyl)-9,9-dioctylfluoren-2-amine;2-N-[4-(7-butan-2-yl-9,9-dioctylfluoren-2-yl)phenyl]-2-N,7-N,7-N-tris(4-methylphenyl)-9,9-dioctylfluorene-2,7-diamine
CID 158073816
9,9-dibutyl-N-[6-[10-(9,9-dibutylfluoren-1-yl)anthracen-9-yl]naphthalen-2-yl]-N-(9,9-dibutyl-7-methylfluoren-2-yl)-7-methylfluoren-2-amine
CID 168837218
2-N,7-N-bis(3-methylphenyl)-9,9-dioctyl-2-N,7-N-diphenylfluorene-2,7-diamine
CID 102383960
N-[4-[9,9-dihexyl-7-[4-(N-(4-methylphenyl)anilino)phenyl]fluoren-2-yl]phenyl]-4-methyl-N-phenylaniline
CID 58251082
9,9-dihexyl-N,N-bis[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]fluoren-2-amine
CID 59470044
2,7-dimethyl-9,9-dioctylfluorene;9,9-dioctylfluorene
CID 162081308
[4-[4-(N-(9,9-dioctylfluoren-2-yl)-3-methylanilino)phenyl]phenyl]methanol
CID 139983913
7-N-[4-(7-butan-2-yl-9,9-dimethylfluoren-2-yl)phenyl]-2-N-[4-(9,9-dioctylfluoren-2-yl)phenyl]-9,9-dimethyl-2-N,7-N-bis(4-methylphenyl)fluorene-2,7-diamine
CID 129302630

Frequently Asked Questions

What is the IUPAC name of 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine?
The IUPAC name of 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine (CID 86165804) is 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine.
What is the SMILES notation for 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine?
The canonical SMILES for 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine is CCCCC1(CCCC)c2ccccc2-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc21.
What is the InChIKey of 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine?
The InChIKey is HJDXFRFLWRWCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H39N/c1-5-7-23-35(24-8-6-2)33-12-10-9-11-31(33)32-22-21-30(25-34(32)35)36(28-17-13-26(3)14-18-28)29-19-15-27(4)16-20-29/h9-22,25H,5-8,23-24H2,1-4H3.
What are the key properties of 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine?
9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine has a molecular weight of 473.70 g/mol, XLogP of 10.42, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dibutyl-N,N-bis(4-methylphenyl)fluoren-2-amine is sourced from PubChem (CID 86165804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).