N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine

C37H27N — CID 166861507

IUPACN-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
SMILESC1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(Nc3ccc(-c4ccccc4)cc3)cc21
InChIInChI=1S/C37H27N/c1-2-10-25(11-3-1)26-18-20-27(21-19-26)38-28-22-23-32-31-14-6-9-17-35(31)37(36(32)24-28)33-15-7-4-12-29(33)30-13-5-8-16-34(30)37/h1-7,9-15,17-24,38H,8,16H2
InChIKeyDBQJCCCHSYOMTM-UHFFFAOYSA-N
MW485.63 g/mol
LogP9.53
Rot. Bonds3

About N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine

N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine (PubChem CID 166861507) has the molecular formula C37H27N and a molecular weight of 485.63 g/mol. Its IUPAC name is N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine.

Molecular Properties

Compound NameN-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
PubChem CID166861507
Molecular FormulaC37H27N
Molecular Weight485.63 g/mol
Exact Mass485.21
IUPAC NameN-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
SMILESC1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(Nc3ccc(-c4ccccc4)cc3)cc21
InChIInChI=1S/C37H27N/c1-2-10-25(11-3-1)26-18-20-27(21-19-26)38-28-22-23-32-31-14-6-9-17-35(31)37(36(32)24-28)33-15-7-4-12-29(33)30-13-5-8-16-34(30)37/h1-7,9-15,17-24,38H,8,16H2
InChIKeyDBQJCCCHSYOMTM-UHFFFAOYSA-N
XLogP9.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.63
LogP ≤ 59.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[9-(4-methylphenyl)-1,2-dihydrofluoren-9-yl]-N-phenylaniline
CID 163520915
1-N,4-N-bis(9,9'-spirobi[fluorene]-2-yl)benzene-1,4-diamine
CID 122468678
N-(4-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
CID 150606722
2-phenyl-3-(7'-pyridin-4-ylspiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-yl)quinoxaline
CID 163579355
N-naphthalen-1-yl-9,9-diphenyl-7,8-dihydrofluoren-2-amine
CID 137427270
N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-3-amine
CID 130271446
7-phenyl-9-[3-(3-phenylphenyl)phenyl]-9-[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-1,2-dihydrofluorene
CID 145189166
9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene
CID 145328119
9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 134528915
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160556555
7'-chloro-N,N-bis(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-1'-amine
CID 142521254
1-methyl-4-phenylbenzene;2-methyl-9,9'-spirobi[fluorene];6,9,9-trimethyl-1,2-dihydrofluorene
CID 178165621

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The IUPAC name of N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine (CID 166861507) is N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine.
What is the SMILES notation for N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The canonical SMILES for N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine is C1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(Nc3ccc(-c4ccccc4)cc3)cc21.
What is the InChIKey of N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The InChIKey is DBQJCCCHSYOMTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27N/c1-2-10-25(11-3-1)26-18-20-27(21-19-26)38-28-22-23-32-31-14-6-9-17-35(31)37(36(32)24-28)33-15-7-4-12-29(33)30-13-5-8-16-34(30)37/h1-7,9-15,17-24,38H,8,16H2.
What are the key properties of N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine has a molecular weight of 485.63 g/mol, XLogP of 9.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 166861507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).