N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine

C28H21N — CID 20654645

IUPACN,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine
SMILESC1=CC2c3cccc4c(N(c5ccccc5)c5ccccc5)ccc(c34)C2C=C1
InChIInChI=1S/C28H21N/c1-3-10-20(11-4-1)29(21-12-5-2-6-13-21)27-19-18-25-23-15-8-7-14-22(23)24-16-9-17-26(27)28(24)25/h1-19,22-23H
InChIKeyUKSYBUAZPOZLEO-UHFFFAOYSA-N
MW371.48 g/mol
LogP7.62
Rot. Bonds3

About N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine

N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine (PubChem CID 20654645) has the molecular formula C28H21N and a molecular weight of 371.48 g/mol. Its IUPAC name is N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine.

Molecular Properties

Compound NameN,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine
PubChem CID20654645
Molecular FormulaC28H21N
Molecular Weight371.48 g/mol
Exact Mass371.17
IUPAC NameN,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine
SMILESC1=CC2c3cccc4c(N(c5ccccc5)c5ccccc5)ccc(c34)C2C=C1
InChIInChI=1S/C28H21N/c1-3-10-20(11-4-1)29(21-12-5-2-6-13-21)27-19-18-25-23-15-8-7-14-22(23)24-16-9-17-26(27)28(24)25/h1-19,22-23H
InChIKeyUKSYBUAZPOZLEO-UHFFFAOYSA-N
XLogP7.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,4-N-dinaphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 87744556
1-N,1-N,6-N,6-N-tetraphenylpyrene-1,6-diamine
CID 23019723
N-cyclohepta-2,4,6-trien-1-yl-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]naphthalen-1-amine
CID 143570887
4-[2-(4a,9a-dihydrocarbazol-9-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-N-phenylnaphthalen-1-amine
CID 167227674
9-N,9-N,10-N,10-N-tetraphenyl-4a,9a-dihydroanthracene-9,10-diamine
CID 160658428
1-N-[4-[4-(N-naphthalen-1-ylanilino)-N-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]-1-N,4-N,4-N-tris[4-(N-naphthalen-1-ylanilino)phenyl]benzene-1,4-diamine
CID 122607218
4-N-naphthalen-1-yl-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 22218375
N,N-diphenyl-4-[(E)-2-[4-(N-phenylanilino)naphthalen-1-yl]ethenyl]naphthalen-1-amine
CID 59412956
5-[N-(5a,9a-dihydrodibenzofuran-4-yl)-2-phenylanilino]-2-[4-(N-phenylanilino)naphthalen-1-yl]phenol
CID 122473560
N,N-diphenyl-5-[5-[5-(N-phenylanilino)naphthalen-1-yl]naphthalen-1-yl]naphthalen-1-amine
CID 20607956
N,N-diphenylnaphthalen-1-amine
CID 11392281
N-(12b,16a-dihydrotetraphenylen-2-yl)-N-phenyltetraphenylen-2-amine
CID 155029369

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine?
The IUPAC name of N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine (CID 20654645) is N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine.
What is the SMILES notation for N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine?
The canonical SMILES for N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine is C1=CC2c3cccc4c(N(c5ccccc5)c5ccccc5)ccc(c34)C2C=C1.
What is the InChIKey of N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine?
The InChIKey is UKSYBUAZPOZLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N/c1-3-10-20(11-4-1)29(21-12-5-2-6-13-21)27-19-18-25-23-15-8-7-14-22(23)24-16-9-17-26(27)28(24)25/h1-19,22-23H.
What are the key properties of N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine?
N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine has a molecular weight of 371.48 g/mol, XLogP of 7.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-6b,10a-dihydrofluoranthen-3-amine is sourced from PubChem (CID 20654645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).