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

C40H27N — CID 164774198

IUPAC1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C40H27N/c1-3-14-32-26-34(23-20-28(32)10-1)41(35-24-21-29-11-2-4-15-33(29)27-35)39-25-22-31-13-6-8-18-37(31)40(39)38-19-9-16-30-12-5-7-17-36(30)38/h1-27H
InChIKeyNBKWNUREKKUNIX-UHFFFAOYSA-N
MW521.66 g/mol
LogP11.44
Rot. Bonds4

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

1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine (PubChem CID 164774198) has the molecular formula C40H27N and a molecular weight of 521.66 g/mol. Its IUPAC name is 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine.

Molecular Properties

Compound Name1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine
PubChem CID164774198
Molecular FormulaC40H27N
Molecular Weight521.66 g/mol
Exact Mass521.21
IUPAC Name1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)ccc2c1
InChIInChI=1S/C40H27N/c1-3-14-32-26-34(23-20-28(32)10-1)41(35-24-21-29-11-2-4-15-33(29)27-35)39-25-22-31-13-6-8-18-37(31)40(39)38-19-9-16-30-12-5-7-17-36(30)38/h1-27H
InChIKeyNBKWNUREKKUNIX-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

9,9-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-3-amine
CID 164774413
4-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-1-amine
CID 59372354
1-naphthalen-1-yl-N,N-diphenylnaphthalen-2-amine
CID 163843201
N,N-bis(3-methylphenyl)-1-naphthalen-1-ylnaphthalen-2-amine
CID 164774001
N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine
CID 164774334
1-naphthalen-1-yl-N,N-bis(2-phenylphenyl)naphthalen-2-amine;1-naphthalen-1-yl-N,N-bis(3-phenylphenyl)naphthalen-2-amine;1-naphthalen-1-yl-N-(2-phenylphenyl)-N-(3-phenylphenyl)naphthalen-2-amine;1-naphthalen-1-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 164980221
N-(4-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)dibenzothiophen-3-amine
CID 164774692
naphthalene;2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 161142905
6-naphthalen-1-yl-N-naphthalen-2-yl-N-(4-phenylphenyl)naphtho[2,3-b][1]benzofuran-1-amine
CID 169295868
11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-2-amine
CID 164774822
N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(4-phenylphenyl)phenanthren-9-amine
CID 164774174
N-(6-cyclohexylnaphthalen-2-yl)-9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 164774478

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine?
The IUPAC name of 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine (CID 164774198) is 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine.
What is the SMILES notation for 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine?
The canonical SMILES for 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine is c1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)ccc2c1.
What is the InChIKey of 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine?
The InChIKey is NBKWNUREKKUNIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27N/c1-3-14-32-26-34(23-20-28(32)10-1)41(35-24-21-29-11-2-4-15-33(29)27-35)39-25-22-31-13-6-8-18-37(31)40(39)38-19-9-16-30-12-5-7-17-36(30)38/h1-27H.
What are the key properties of 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine?
1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-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 1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine is sourced from PubChem (CID 164774198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).