N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine

C34H27N — CID 71099967

IUPACN,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)Cc2cc4c(cc2-3)Cc2ccccc2-4)cc1
InChIInChI=1S/C34H27N/c1-22-7-11-28(12-8-22)35(29-13-9-23(2)10-14-29)30-15-16-32-25(19-30)18-27-21-33-26(20-34(27)32)17-24-5-3-4-6-31(24)33/h3-16,19-21H,17-18H2,1-2H3
InChIKeyQVFSUIWSMYJAGQ-UHFFFAOYSA-N
MW449.60 g/mol
LogP8.92
Rot. Bonds3

About N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine

N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine (PubChem CID 71099967) has the molecular formula C34H27N and a molecular weight of 449.60 g/mol. Its IUPAC name is N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine.

Molecular Properties

Compound NameN,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine
PubChem CID71099967
Molecular FormulaC34H27N
Molecular Weight449.60 g/mol
Exact Mass449.21
IUPAC NameN,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)Cc2cc4c(cc2-3)Cc2ccccc2-4)cc1
InChIInChI=1S/C34H27N/c1-22-7-11-28(12-8-22)35(29-13-9-23(2)10-14-29)30-15-16-32-25(19-30)18-27-21-33-26(20-34(27)32)17-24-5-3-4-6-31(24)33/h3-16,19-21H,17-18H2,1-2H3
InChIKeyQVFSUIWSMYJAGQ-UHFFFAOYSA-N
XLogP8.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.60
LogP ≤ 58.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-diphenyl-9H-fluoren-2-amine
CID 20734444
N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine
CID 158984824
4-(9H-fluoren-3-yl)-N,N-diphenylaniline
CID 157436916
4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline
CID 157107572
N,N-bis(4-methoxyphenyl)-9H-fluoren-3-amine
CID 161479064
3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
CID 146386867
nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
N,N-diethyl-6-methyl-9H-fluoren-2-amine
CID 67711573
2-N,7-N-bis(9H-fluoren-2-yl)-2-N,7-N-bis(7-methyl-9H-fluoren-2-yl)-9H-fluorene-2,7-diamine;2-N',7-N'-bis(7'-methyl-9,9'-spirobi[fluorene]-2'-yl)-2-N',7-N'-diphenyl-9,9'-spirobi[fluorene]-2',7'-diamine;(4-methylphenyl)-[7-[(4-methylphenyl)-phenylphosphanyl]-9H-fluoren-2-yl]-phenylphosphane;(4-methylphenyl)-[7'-[(4-methylphenyl)-phenylphosphanyl]-9,9'-spirobi[fluorene]-2'-yl]-phenylphosphane
CID 159087588
4-N-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-1-N,1-N,4-N-tris(4-methylphenyl)benzene-1,4-diamine
CID 158470830
4-N-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-4-N-[4-[N-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-4-(4-methyl-N-(4-methylphenyl)anilino)anilino]phenyl]-1-N,1-N-bis(4-methylphenyl)benzene-1,4-diamine
CID 144971641
4-(9H-fluoren-2-yl)-N-[4-(9H-fluoren-3-yl)phenyl]-N-methylaniline
CID 121465169

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine?
The IUPAC name of N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine (CID 71099967) is N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine.
What is the SMILES notation for N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine?
The canonical SMILES for N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine is Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)Cc2cc4c(cc2-3)Cc2ccccc2-4)cc1.
What is the InChIKey of N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine?
The InChIKey is QVFSUIWSMYJAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H27N/c1-22-7-11-28(12-8-22)35(29-13-9-23(2)10-14-29)30-15-16-32-25(19-30)18-27-21-33-26(20-34(27)32)17-24-5-3-4-6-31(24)33/h3-16,19-21H,17-18H2,1-2H3.
What are the key properties of N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine?
N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine has a molecular weight of 449.60 g/mol, XLogP of 8.92, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine is sourced from PubChem (CID 71099967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).