N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine

C39H29NO — CID 164774334

IUPACN-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine
SMILESCOc1ccc(N(c2cccc(-c3ccccc3)c2)c2ccc3ccccc3c2-c2cccc3ccccc23)cc1
InChIInChI=1S/C39H29NO/c1-41-34-24-22-32(23-25-34)40(33-17-9-16-31(27-33)28-11-3-2-4-12-28)38-26-21-30-14-6-8-19-36(30)39(38)37-20-10-15-29-13-5-7-18-35(29)37/h2-27H,1H3
InChIKeyBHWFSLWNCQWNKN-UHFFFAOYSA-N
MW527.67 g/mol
LogP10.81
Rot. Bonds6

About N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine

N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine (PubChem CID 164774334) has the molecular formula C39H29NO and a molecular weight of 527.67 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine
PubChem CID164774334
Molecular FormulaC39H29NO
Molecular Weight527.67 g/mol
Exact Mass527.22
IUPAC NameN-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine
SMILESCOc1ccc(N(c2cccc(-c3ccccc3)c2)c2ccc3ccccc3c2-c2cccc3ccccc23)cc1
InChIInChI=1S/C39H29NO/c1-41-34-24-22-32(23-25-34)40(33-17-9-16-31(27-33)28-11-3-2-4-12-28)38-26-21-30-14-6-8-19-36(30)39(38)37-20-10-15-29-13-5-7-18-35(29)37/h2-27H,1H3
InChIKeyBHWFSLWNCQWNKN-UHFFFAOYSA-N
XLogP10.81
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.67
LogP ≤ 510.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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
9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(3-phenylphenyl)fluoren-2-amine
CID 164774882
1-naphthalen-1-yl-N,N-diphenylnaphthalen-2-amine
CID 163843201
1-naphthalen-1-yl-N,N-dinaphthalen-2-ylnaphthalen-2-amine
CID 164774198
N,1-diphenyl-N-[3-[4-[3-(N-phenylanilino)phenyl]phenyl]phenyl]naphthalen-2-amine
CID 176611838
11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(3-phenylphenyl)benzo[b]fluoren-4-amine
CID 164774770
N,N-bis(3-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N-(4-methoxyphenyl)-N-(4-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N-(4-methoxyphenyl)-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine;N-(4-methylphenyl)-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine
CID 165046285
N,17-diphenyl-N-[1-(3-phenylphenyl)naphthalen-2-yl]pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaen-6-amine
CID 171728735
N,N-bis(3-methylphenyl)-1-naphthalen-1-ylnaphthalen-2-amine
CID 164774001
1-naphthalen-1-yl-N-phenyl-N-(2-phenylphenyl)naphthalen-2-amine
CID 164774553
N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(4-phenylphenyl)phenanthren-9-amine
CID 164774174
N-[4-[4-(3-methoxy-N-methylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-1-amine
CID 59431567

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine?
The IUPAC name of N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine (CID 164774334) is N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine?
The canonical SMILES for N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine is COc1ccc(N(c2cccc(-c3ccccc3)c2)c2ccc3ccccc3c2-c2cccc3ccccc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine?
The InChIKey is BHWFSLWNCQWNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H29NO/c1-41-34-24-22-32(23-25-34)40(33-17-9-16-31(27-33)28-11-3-2-4-12-28)38-26-21-30-14-6-8-19-36(30)39(38)37-20-10-15-29-13-5-7-18-35(29)37/h2-27H,1H3.
What are the key properties of N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine?
N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine has a molecular weight of 527.67 g/mol, XLogP of 10.81, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-naphthalen-1-yl-N-(3-phenylphenyl)naphthalen-2-amine is sourced from PubChem (CID 164774334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).