ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine

C35H28N2 — CID 144605066

IUPACethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine
SMILESCC.c1ccc(N(c2cccc(-c3ccc4c(c3)-c3cccc5cccc-4c35)c2)c2ccccn2)cc1
InChIInChI=1S/C33H22N2.C2H6/c1-2-12-26(13-3-1)35(32-17-4-5-20-34-32)27-14-6-11-24(21-27)25-18-19-28-29-15-7-9-23-10-8-16-30(33(23)29)31(28)22-25;1-2/h1-22H;1-2H3
InChIKeyNPVRQQSLKASIEJ-UHFFFAOYSA-N
MW476.62 g/mol
LogP10.05
Rot. Bonds4

About ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine

ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine (PubChem CID 144605066) has the molecular formula C35H28N2 and a molecular weight of 476.62 g/mol. Its IUPAC name is ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine.

Molecular Properties

Compound Nameethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine
PubChem CID144605066
Molecular FormulaC35H28N2
Molecular Weight476.62 g/mol
Exact Mass476.23
IUPAC Nameethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine
SMILESCC.c1ccc(N(c2cccc(-c3ccc4c(c3)-c3cccc5cccc-4c35)c2)c2ccccn2)cc1
InChIInChI=1S/C33H22N2.C2H6/c1-2-12-26(13-3-1)35(32-17-4-5-20-34-32)27-14-6-11-24(21-27)25-18-19-28-29-15-7-9-23-10-8-16-30(33(23)29)31(28)22-25;1-2/h1-22H;1-2H3
InChIKeyNPVRQQSLKASIEJ-UHFFFAOYSA-N
XLogP10.05
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.62
LogP ≤ 510.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
CID 23135801
N-[3-(3-fluoranthen-8-ylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 139499112
2-[4-(N-phenylanilino)-6-[3-(3-phenyl-N-pyridin-2-ylanilino)phenyl]-2-pyridinyl]phenol
CID 155627571
N-fluoranthen-8-yl-N-phenylpyridin-3-amine
CID 118410662
N,N-diphenyl-3-[3-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-3-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;ethane
CID 159114076
2-[6-[3-[4-(1-phenylethyl)-N-pyridin-2-ylanilino]phenyl]-2-pyridinyl]phenol
CID 164742080
2-[2-(2,5-diphenylphenyl)phenyl]-N-(3-naphthalen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 172502216
N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-N-[3-(5-phenylthiophen-2-yl)phenyl]pyridin-2-amine
CID 58121679
N-phenanthren-2-yl-N-(4-phenylphenyl)fluoranthen-8-amine
CID 166875448
2,9-diphenylfluoranthene
CID 174565991
N-(4-fluoranthen-8-ylphenyl)-N-(4-phenylphenyl)-[1]benzofuro[3,2-c]pyridin-6-amine
CID 168737831
N-[3-[4-[8-[4-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]naphthalen-1-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 169016062

Frequently Asked Questions

What is the IUPAC name of ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine?
The IUPAC name of ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine (CID 144605066) is ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine.
What is the SMILES notation for ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine?
The canonical SMILES for ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine is CC.c1ccc(N(c2cccc(-c3ccc4c(c3)-c3cccc5cccc-4c35)c2)c2ccccn2)cc1.
What is the InChIKey of ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine?
The InChIKey is NPVRQQSLKASIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H22N2.C2H6/c1-2-12-26(13-3-1)35(32-17-4-5-20-34-32)27-14-6-11-24(21-27)25-18-19-28-29-15-7-9-23-10-8-16-30(33(23)29)31(28)22-25;1-2/h1-22H;1-2H3.
What are the key properties of ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine?
ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine has a molecular weight of 476.62 g/mol, XLogP of 10.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(3-fluoranthen-8-ylphenyl)-N-phenylpyridin-2-amine is sourced from PubChem (CID 144605066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).