N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine

C31H27N — CID 138581690

IUPACN-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine
SMILESC1=C(Nc2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)CCCC1
InChIInChI=1S/C31H27N/c1-4-12-23(13-5-1)31(24-14-6-2-7-15-24)29-19-11-10-18-27(29)28-21-20-26(22-30(28)31)32-25-16-8-3-9-17-25/h1-2,4-7,10-16,18-22,32H,3,8-9,17H2
InChIKeyXDFQETZTAVFUDI-UHFFFAOYSA-N
MW413.56 g/mol
LogP7.92
Rot. Bonds4

About N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine

N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine (PubChem CID 138581690) has the molecular formula C31H27N and a molecular weight of 413.56 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine
PubChem CID138581690
Molecular FormulaC31H27N
Molecular Weight413.56 g/mol
Exact Mass413.21
IUPAC NameN-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine
SMILESC1=C(Nc2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)CCCC1
InChIInChI=1S/C31H27N/c1-4-12-23(13-5-1)31(24-14-6-2-7-15-24)29-19-11-10-18-27(29)28-21-20-26(22-30(28)31)32-25-16-8-3-9-17-25/h1-2,4-7,10-16,18-22,32H,3,8-9,17H2
InChIKeyXDFQETZTAVFUDI-UHFFFAOYSA-N
XLogP7.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.56
LogP ≤ 57.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(cyclohexen-1-yl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]aniline
CID 154955243
N-(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-2-amine
CID 121423904
N-[3-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 138519337
N-(2-chlorophenyl)-9,9-diphenylfluoren-2-amine
CID 126695799
9,9-diphenyl-N-(4-triphenylsilylphenyl)fluoren-2-amine
CID 175823474
1-N,4-N-bis(9,9'-spirobi[fluorene]-2-yl)benzene-1,4-diamine
CID 122468678
N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 177113841
9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine
CID 153470826
2-N,7-N-bis(4-fluorophenyl)-9,9-diphenylfluorene-2,7-diamine
CID 172547033
3-N-(9,9-diphenylfluoren-2-yl)-1-N-(3-methylphenyl)-5-phenylbenzene-1,3-diamine
CID 139380106
dibenzothiophene;9,9-diphenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine
CID 142480827
N-(4-dibenzofuran-1-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 175441653

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine?
The IUPAC name of N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine (CID 138581690) is N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine.
What is the SMILES notation for N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine?
The canonical SMILES for N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine is C1=C(Nc2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)CCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine?
The InChIKey is XDFQETZTAVFUDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H27N/c1-4-12-23(13-5-1)31(24-14-6-2-7-15-24)29-19-11-10-18-27(29)28-21-20-26(22-30(28)31)32-25-16-8-3-9-17-25/h1-2,4-7,10-16,18-22,32H,3,8-9,17H2.
What are the key properties of N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine?
N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine has a molecular weight of 413.56 g/mol, XLogP of 7.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine is sourced from PubChem (CID 138581690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).