9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine

C46H39N — CID 171740959

IUPAC9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine
SMILESCC(C)c1cccc2c1-c1ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4ccccc4cc3-c3ccccc3)cc1C2(C)C
InChIInChI=1S/C46H39N/c1-31(2)39-20-13-21-42-45(39)40-27-26-38(30-43(40)46(42,3)4)47(37-24-22-33(23-25-37)32-14-7-5-8-15-32)44-29-36-19-12-11-18-35(36)28-41(44)34-16-9-6-10-17-34/h5-31H,1-4H3
InChIKeyAZKKVORKTRDOMN-UHFFFAOYSA-N
MW605.83 g/mol
LogP13.07
Rot. Bonds6

About 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine

9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine (PubChem CID 171740959) has the molecular formula C46H39N and a molecular weight of 605.83 g/mol. Its IUPAC name is 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine
PubChem CID171740959
Molecular FormulaC46H39N
Molecular Weight605.83 g/mol
Exact Mass605.31
IUPAC Name9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine
SMILESCC(C)c1cccc2c1-c1ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4ccccc4cc3-c3ccccc3)cc1C2(C)C
InChIInChI=1S/C46H39N/c1-31(2)39-20-13-21-42-45(39)40-27-26-38(30-43(40)46(42,3)4)47(37-24-22-33(23-25-37)32-14-7-5-8-15-32)44-29-36-19-12-11-18-35(36)28-41(44)34-16-9-6-10-17-34/h5-31H,1-4H3
InChIKeyAZKKVORKTRDOMN-UHFFFAOYSA-N
XLogP13.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500605.83
LogP ≤ 513.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(4-cyclohexylphenyl)phenyl]-9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-5-propan-2-ylfluoren-2-amine
CID 171740912
9,9-dimethyl-N,5-diphenyl-N-[3-[3-(4-phenylphenyl)naphthalen-2-yl]phenyl]fluoren-2-amine
CID 170417832
9,9-dimethyl-N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 139352574
5,9,9-trimethyl-N-phenyl-N-[3-(2-phenylphenyl)naphthalen-2-yl]fluoren-2-amine
CID 171741066
9,9-dimethyl-5-phenyl-N-[3-(4-phenylphenyl)naphthalen-2-yl]-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170538744
9,9-dimethyl-N-(1-naphthalen-2-ylnaphthalen-2-yl)-5-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 170417611
N-(9,9-dimethyl-5-propan-2-ylfluoren-2-yl)-N-[4-(1-phenylnaphthalen-2-yl)phenyl]dibenzothiophen-1-amine
CID 171741024
9,9-dimethyl-5-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155153854
7,7-dimethyl-1-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)benzo[a]phenalen-9-amine
CID 167232028
9,9-dimethyl-5-naphthalen-2-yl-3-phenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 170529491
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]naphthalen-2-amine
CID 169020198
9,9-dimethyl-N-(2-naphthalen-2-yl-3-phenylphenyl)-N-phenylfluoren-2-amine
CID 167293376

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine (CID 171740959) is 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine is CC(C)c1cccc2c1-c1ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4ccccc4cc3-c3ccccc3)cc1C2(C)C.
What is the InChIKey of 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine?
The InChIKey is AZKKVORKTRDOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H39N/c1-31(2)39-20-13-21-42-45(39)40-27-26-38(30-43(40)46(42,3)4)47(37-24-22-33(23-25-37)32-14-7-5-8-15-32)44-29-36-19-12-11-18-35(36)28-41(44)34-16-9-6-10-17-34/h5-31H,1-4H3.
What are the key properties of 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine?
9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine has a molecular weight of 605.83 g/mol, XLogP of 13.07, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-(3-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)-5-propan-2-ylfluoren-2-amine is sourced from PubChem (CID 171740959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).