ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine

C31H33N — CID 143983755

IUPACethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
SMILESCC.CC.CN(c1ccc(-c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C27H21N.2C2H6/c1-28(27-17-14-21-7-3-5-9-24(21)19-27)26-15-12-22(13-16-26)25-11-10-20-6-2-4-8-23(20)18-25;2*1-2/h2-19H,1H3;2*1-2H3
InChIKeyCPWFPRJXZREYMN-UHFFFAOYSA-N
MW419.61 g/mol
LogP9.48
Rot. Bonds3

About ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine

ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine (PubChem CID 143983755) has the molecular formula C31H33N and a molecular weight of 419.61 g/mol. Its IUPAC name is ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine.

Molecular Properties

Compound Nameethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
PubChem CID143983755
Molecular FormulaC31H33N
Molecular Weight419.61 g/mol
Exact Mass419.26
IUPAC Nameethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
SMILESCC.CC.CN(c1ccc(-c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C27H21N.2C2H6/c1-28(27-17-14-21-7-3-5-9-24(21)19-27)26-15-12-22(13-16-26)25-11-10-20-6-2-4-8-23(20)18-25;2*1-2/h2-19H,1H3;2*1-2H3
InChIKeyCPWFPRJXZREYMN-UHFFFAOYSA-N
XLogP9.48
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.61
LogP ≤ 59.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-N-phenylaniline;4-naphthalen-2-yl-N,N-diphenylaniline
CID 145077482
N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-methylnaphthalen-2-amine;N-[4-[4-(N-methyl-4-phenylanilino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 161479413
N-methyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]naphthalen-2-amine;N-methyl-4-phenyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 158523438
N-methyl-3-naphthalen-2-yl-N-phenylaniline
CID 149001874
N-[4-[4-(N-methyl-3-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-2-amine
CID 59431625
N-[4-[4-(N-methyl-3-phenylanilino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 59431911
1-N-methyl-4-N,4-N-dinaphthalen-2-yl-1-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-2-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine;1-N-methyl-1-N,4-N,4-N-trinaphthalen-2-ylbenzene-1,4-diamine
CID 159683309
N,N-dimethyl-4-naphthalen-2-ylaniline
CID 46854357
N,2-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 142481987
N-methyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]anthracen-2-amine
CID 59431583
N-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 153292153
1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-naphthalen-2-ylbenzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine
CID 158106660

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine?
The IUPAC name of ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine (CID 143983755) is ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine.
What is the SMILES notation for ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine?
The canonical SMILES for ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine is CC.CC.CN(c1ccc(-c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1.
What is the InChIKey of ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine?
The InChIKey is CPWFPRJXZREYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N.2C2H6/c1-28(27-17-14-21-7-3-5-9-24(21)19-27)26-15-12-22(13-16-26)25-11-10-20-6-2-4-8-23(20)18-25;2*1-2/h2-19H,1H3;2*1-2H3.
What are the key properties of ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine?
ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine has a molecular weight of 419.61 g/mol, XLogP of 9.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine is sourced from PubChem (CID 143983755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).