N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine

C37H26N2 — CID 118003349

IUPACN-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc4ccc5cccnc5c34)cc2)cc1
InChIInChI=1S/C37H26N2/c1-3-10-27(11-4-1)29-21-23-33(24-22-29)39(34-17-7-15-32(26-34)28-12-5-2-6-13-28)35-18-8-14-30-19-20-31-16-9-25-38-37(31)36(30)35/h1-26H
InChIKeyYCOAGULOMNZPIH-UHFFFAOYSA-N
MW498.63 g/mol
LogP10.19
Rot. Bonds5

About N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine

N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine (PubChem CID 118003349) has the molecular formula C37H26N2 and a molecular weight of 498.63 g/mol. Its IUPAC name is N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine.

Molecular Properties

Compound NameN-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine
PubChem CID118003349
Molecular FormulaC37H26N2
Molecular Weight498.63 g/mol
Exact Mass498.21
IUPAC NameN-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc4ccc5cccnc5c34)cc2)cc1
InChIInChI=1S/C37H26N2/c1-3-10-27(11-4-1)29-21-23-33(24-22-29)39(34-17-7-15-32(26-34)28-12-5-2-6-13-28)35-18-8-14-30-19-20-31-16-9-25-38-37(31)36(30)35/h1-26H
InChIKeyYCOAGULOMNZPIH-UHFFFAOYSA-N
XLogP10.19
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.63
LogP ≤ 510.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

N-(3-benzo[h]quinolin-10-ylphenyl)-2-phenyl-N-(4-phenylphenyl)aniline
CID 118003274
N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[c][1,5]naphthyridin-10-amine
CID 118003465
N-[4-[4-(N-naphthalen-1-yl-3-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-1-amine
CID 166859975
4-N-naphthalen-2-yl-1-N-[4-(N-naphthalen-2-ylanilino)phenyl]-1-N-[4-[N-naphthalen-2-yl-3-[3-[N-naphthalen-1-yl-4-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]anilino]phenyl]-4-N-phenylbenzene-1,4-diamine
CID 130281141
1-N,10-N-diphenyl-1-N,10-N-bis(3-phenylphenyl)chrysene-1,10-diamine
CID 170410737
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
N-phenyl-N,8-bis(3-phenylphenyl)naphthalen-1-amine
CID 166041816
N-[4-[4-[4-[4-[4-[4-(N-naphthalen-1-ylanilino)phenyl]-N-(3-phenylphenyl)anilino]phenyl]-N-(3-phenylphenyl)anilino]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 143438558
N-phenyl-N-(4-phenylphenyl)-[1]benzofuro[3,2-b]pyridin-9-amine
CID 168737884
N,3-diphenyl-N-[4-[4-(N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-2-amine;N-naphthalen-1-yl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]naphthalen-1-amine;3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)aniline;3-phenyl-N-(3-phenylphenyl)-N-[4-[4-(3-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 161474409
1-N,4-N-dinaphthalen-1-yl-1-N-[4-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-yl-3-pyrimidin-2-ylanilino)anilino]phenyl]phenyl]-4-N-(3-pyrimidin-2-ylphenyl)benzene-1,4-diamine
CID 58612735
N-[3-[4-(N-[4-[3-[3-(N-[4-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 122414006

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine?
The IUPAC name of N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine (CID 118003349) is N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine.
What is the SMILES notation for N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine?
The canonical SMILES for N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine is c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc4ccc5cccnc5c34)cc2)cc1.
What is the InChIKey of N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine?
The InChIKey is YCOAGULOMNZPIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2/c1-3-10-27(11-4-1)29-21-23-33(24-22-29)39(34-17-7-15-32(26-34)28-12-5-2-6-13-28)35-18-8-14-30-19-20-31-16-9-25-38-37(31)36(30)35/h1-26H.
What are the key properties of N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine?
N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine has a molecular weight of 498.63 g/mol, XLogP of 10.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylphenyl)-N-(4-phenylphenyl)benzo[h]quinolin-10-amine is sourced from PubChem (CID 118003349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).