1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine

C55H41N — CID 164744618

IUPAC1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine
SMILESCC1(C)C=Cc2cc(N(c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc21
InChIInChI=1S/C55H41N/c1-55(2)34-33-50-37-53(31-32-54(50)55)56(51-27-23-42(24-28-51)40-11-15-44(16-12-40)48-21-19-38-7-3-5-9-46(38)35-48)52-29-25-43(26-30-52)41-13-17-45(18-14-41)49-22-20-39-8-4-6-10-47(39)36-49/h3-37H,1-2H3
InChIKeyOJQMJHRFJAUXJY-UHFFFAOYSA-N
MW715.94 g/mol
LogP15.44
Rot. Bonds7

About 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine

1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine (PubChem CID 164744618) has the molecular formula C55H41N and a molecular weight of 715.94 g/mol. Its IUPAC name is 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine.

Molecular Properties

Compound Name1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine
PubChem CID164744618
Molecular FormulaC55H41N
Molecular Weight715.94 g/mol
Exact Mass715.32
IUPAC Name1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine
SMILESCC1(C)C=Cc2cc(N(c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc21
InChIInChI=1S/C55H41N/c1-55(2)34-33-50-37-53(31-32-54(50)55)56(51-27-23-42(24-28-51)40-11-15-44(16-12-40)48-21-19-38-7-3-5-9-46(38)35-48)52-29-25-43(26-30-52)41-13-17-45(18-14-41)49-22-20-39-8-4-6-10-47(39)36-49/h3-37H,1-2H3
InChIKeyOJQMJHRFJAUXJY-UHFFFAOYSA-N
XLogP15.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.94
LogP ≤ 515.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 153292153
N-phenyl-N-[3-[4-[3-(4-phenyl-N-(1,1,3,3-tetramethyl-2H-inden-5-yl)anilino)phenyl]phenyl]phenyl]naphthalen-2-amine
CID 170223052
N-[4-(1,1-dimethylinden-2-yl)phenyl]-N,4-bis(4-naphthalen-2-ylphenyl)aniline
CID 164744877
3-naphthalen-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 167236634
3-(9,9-dimethylfluoren-3-yl)-N-[3-(9,9-dimethylfluoren-3-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)aniline
CID 154972891
N-[4-[3-[3-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 121286442
3,3-dimethyl-N,N-bis(4-naphthalen-2-ylphenyl)cyclopenta[b]naphthalen-2-amine
CID 164744460
N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-3-phenyl-N-(3-phenylphenyl)aniline
CID 166565645
3-naphthalen-2-yl-N-[3-(3-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167323928
9,9-dimethyl-6-naphthalen-2-yl-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 130250393
N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine
CID 129085267
N-(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)-9,9-dimethyl-N,7-diphenylfluoren-2-amine
CID 118500262

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine?
The IUPAC name of 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine (CID 164744618) is 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine.
What is the SMILES notation for 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine?
The canonical SMILES for 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine is CC1(C)C=Cc2cc(N(c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc21.
What is the InChIKey of 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine?
The InChIKey is OJQMJHRFJAUXJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H41N/c1-55(2)34-33-50-37-53(31-32-54(50)55)56(51-27-23-42(24-28-51)40-11-15-44(16-12-40)48-21-19-38-7-3-5-9-46(38)35-48)52-29-25-43(26-30-52)41-13-17-45(18-14-41)49-22-20-39-8-4-6-10-47(39)36-49/h3-37H,1-2H3.
What are the key properties of 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine?
1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine has a molecular weight of 715.94 g/mol, XLogP of 15.44, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-N,N-bis[4-(4-naphthalen-2-ylphenyl)phenyl]inden-5-amine is sourced from PubChem (CID 164744618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).