N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

C47H37N — CID 90694175

IUPACN-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCC(c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C47H37N/c1-34(47(40-16-4-2-5-17-40)45-24-12-18-38-14-8-10-22-43(38)45)35-26-28-36(29-27-35)37-30-32-42(33-31-37)48(41-20-6-3-7-21-41)46-25-13-19-39-15-9-11-23-44(39)46/h2-34,47H,1H3
InChIKeyPEPULKUDQFVKQG-UHFFFAOYSA-N
MW615.82 g/mol
LogP13.07
Rot. Bonds8

About N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 90694175) has the molecular formula C47H37N and a molecular weight of 615.82 g/mol. Its IUPAC name is N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
PubChem CID90694175
Molecular FormulaC47H37N
Molecular Weight615.82 g/mol
Exact Mass615.29
IUPAC NameN-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCC(c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(c1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C47H37N/c1-34(47(40-16-4-2-5-17-40)45-24-12-18-38-14-8-10-22-43(38)45)35-26-28-36(29-27-35)37-30-32-42(33-31-37)48(41-20-6-3-7-21-41)46-25-13-19-39-15-9-11-23-44(39)46/h2-34,47H,1H3
InChIKeyPEPULKUDQFVKQG-UHFFFAOYSA-N
XLogP13.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500615.82
LogP ≤ 513.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[4-[N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-[4-[4-(N-[4-[4-(N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 155471012
N,N-diphenyl-4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]aniline;N-phenyl-4-(4-phenylphenyl)-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;N-phenyl-N-[4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]phenyl]naphthalen-1-amine
CID 160952409
N-[4-[4-(N-[4-[4-[N-naphthalen-1-yl-4-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 58713806
N-phenyl-N-[4-[4-(4-phenyl-N-[4-[4-[4-[4-(4-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]phenyl]anilino)phenyl]phenyl]naphthalen-1-amine
CID 134455282
N-[4-[4-(N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 161384258
N-[4-[4-[4-(N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-4-phenylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]aniline
CID 162077665
N-(4-phenylphenyl)-N-[4-[4-[4-(N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]naphthalen-1-amine
CID 58729730
N-[4-[4-(N-naphthalen-1-yl-4-propan-2-ylanilino)phenyl]phenyl]-N-(4-propan-2-ylphenyl)naphthalen-1-amine
CID 66791153
1,1'-biphenyl;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 172802336
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[4-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]phenyl]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 58612738
N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 59650467
N-[4-[4-(1-naphthalen-1-yl-2-phenylethyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 143944265

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 90694175) is N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is CC(c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(c1ccccc1)c1cccc2ccccc12.
What is the InChIKey of N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is PEPULKUDQFVKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H37N/c1-34(47(40-16-4-2-5-17-40)45-24-12-18-38-14-8-10-22-43(38)45)35-26-28-36(29-27-35)37-30-32-42(33-31-37)48(41-20-6-3-7-21-41)46-25-13-19-39-15-9-11-23-44(39)46/h2-34,47H,1H3.
What are the key properties of N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 615.82 g/mol, XLogP of 13.07, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(1-naphthalen-1-yl-1-phenylpropan-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 90694175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).