4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine

C40H27N — CID 59372354

IUPAC4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc(-c4cccc5ccccc45)c4ccccc34)ccc2c1
InChIInChI=1S/C40H27N/c1-3-13-31-26-33(22-20-28(31)10-1)41(34-23-21-29-11-2-4-14-32(29)27-34)40-25-24-38(37-17-7-8-18-39(37)40)36-19-9-15-30-12-5-6-16-35(30)36/h1-27H
InChIKeyDMUXHPSKQCPNPI-UHFFFAOYSA-N
MW521.66 g/mol
LogP11.44
Rot. Bonds4

About 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine

4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine (PubChem CID 59372354) has the molecular formula C40H27N and a molecular weight of 521.66 g/mol. Its IUPAC name is 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine.

Molecular Properties

Compound Name4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine
PubChem CID59372354
Molecular FormulaC40H27N
Molecular Weight521.66 g/mol
Exact Mass521.21
IUPAC Name4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc(-c4cccc5ccccc45)c4ccccc34)ccc2c1
InChIInChI=1S/C40H27N/c1-3-13-31-26-33(22-20-28(31)10-1)41(34-23-21-29-11-2-4-14-32(29)27-34)40-25-24-38(37-17-7-8-18-39(37)40)36-19-9-15-30-12-5-6-16-35(30)36/h1-27H
InChIKeyDMUXHPSKQCPNPI-UHFFFAOYSA-N
XLogP11.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.66
LogP ≤ 511.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine
CID 164774198
naphthalene;2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 161142905
N,N-diphenyl-4-[5-[4-[4-(N-phenylanilino)naphthalen-1-yl]naphthalen-1-yl]naphthalen-1-yl]naphthalen-1-amine;N,N-diphenyl-4-[5-[4-[6-(N-phenylanilino)naphthalen-2-yl]naphthalen-1-yl]naphthalen-1-yl]naphthalen-1-amine
CID 158475864
2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 159424391
ethane;7-naphthalen-1-yl-N,N-diphenylphenanthren-2-amine;8-naphthalen-1-yl-N,N-diphenylphenanthren-1-amine;4-naphthalen-1-yl-N-(4-naphthalen-1-ylnaphthalen-1-yl)-N-phenylnaphthalen-1-amine;5-naphthalen-1-yl-N-(5-naphthalen-1-ylnaphthalen-1-yl)-N-phenylnaphthalen-1-amine;6-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)naphthalen-2-amine
CID 160719608
4-N-naphthalen-2-yl-1-N-[4-(N-naphthalen-1-ylanilino)phenyl]-1-N-[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 58598982
4-chrysen-1-yl-N-(3-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 170142135
4-naphthalen-1-yl-N-naphthalen-2-yl-N-phenanthren-1-yldibenzofuran-1-amine
CID 176820677
2,5-dinaphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167234726
N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]phenyl]naphthalen-2-amine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-(3-phenylphenyl)phenyl]-N-[4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]phenyl]naphthalen-1-amine
CID 159824921
N-[3-methyl-4-[2-methyl-4-(N-naphthalen-2-ylanilino)phenyl]phenyl]-5-[2-methyl-4-(N-naphthalen-2-ylanilino)phenyl]-N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]naphthalen-1-amine
CID 58121806
1-N,1-N,6-N,6-N-tetranaphthalen-2-ylpyrene-1,6-diamine
CID 59027571

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine?
The IUPAC name of 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine (CID 59372354) is 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine.
What is the SMILES notation for 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine?
The canonical SMILES for 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine is c1ccc2cc(N(c3ccc4ccccc4c3)c3ccc(-c4cccc5ccccc45)c4ccccc34)ccc2c1.
What is the InChIKey of 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine?
The InChIKey is DMUXHPSKQCPNPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27N/c1-3-13-31-26-33(22-20-28(31)10-1)41(34-23-21-29-11-2-4-14-32(29)27-34)40-25-24-38(37-17-7-8-18-39(37)40)36-19-9-15-30-12-5-6-16-35(30)36/h1-27H.
What are the key properties of 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine?
4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine has a molecular weight of 521.66 g/mol, XLogP of 11.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine is sourced from PubChem (CID 59372354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).