5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine

C32H33N — CID 174330207

IUPAC5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(Nc3ccc(-c4ccc(-c5ccccc5)cc4)cc3)ccc21
InChIInChI=1S/C32H33N/c1-31(2)20-21-32(3,4)30-22-28(18-19-29(30)31)33-27-16-14-26(15-17-27)25-12-10-24(11-13-25)23-8-6-5-7-9-23/h5-19,22,33H,20-21H2,1-4H3
InChIKeyYETIRVWZKBZDHR-UHFFFAOYSA-N
MW431.62 g/mol
LogP9.11
Rot. Bonds4

About 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine

5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine (PubChem CID 174330207) has the molecular formula C32H33N and a molecular weight of 431.62 g/mol. Its IUPAC name is 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine.

Molecular Properties

Compound Name5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine
PubChem CID174330207
Molecular FormulaC32H33N
Molecular Weight431.62 g/mol
Exact Mass431.26
IUPAC Name5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(Nc3ccc(-c4ccc(-c5ccccc5)cc4)cc3)ccc21
InChIInChI=1S/C32H33N/c1-31(2)20-21-32(3,4)30-22-28(18-19-29(30)31)33-27-16-14-26(15-17-27)25-12-10-24(11-13-25)23-8-6-5-7-9-23/h5-19,22,33H,20-21H2,1-4H3
InChIKeyYETIRVWZKBZDHR-UHFFFAOYSA-N
XLogP9.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.62
LogP ≤ 59.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine?
The IUPAC name of 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine (CID 174330207) is 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine.
What is the SMILES notation for 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine?
The canonical SMILES for 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine is CC1(C)CCC(C)(C)c2cc(Nc3ccc(-c4ccc(-c5ccccc5)cc4)cc3)ccc21.
What is the InChIKey of 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine?
The InChIKey is YETIRVWZKBZDHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H33N/c1-31(2)20-21-32(3,4)30-22-28(18-19-29(30)31)33-27-16-14-26(15-17-27)25-12-10-24(11-13-25)23-8-6-5-7-9-23/h5-19,22,33H,20-21H2,1-4H3.
What are the key properties of 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine?
5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine has a molecular weight of 431.62 g/mol, XLogP of 9.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,8,8-tetramethyl-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydronaphthalen-2-amine is sourced from PubChem (CID 174330207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).