N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine

C33H27N — CID 156757141

IUPACN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine
SMILESC=Cc1ccc(Nc2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12
InChIInChI=1S/C33H27N/c1-4-22-16-20-32(29-11-6-5-9-26(22)29)34-25-17-13-23(14-18-25)24-15-19-28-27-10-7-8-12-30(27)33(2,3)31(28)21-24/h4-21,34H,1H2,2-3H3
InChIKeyMKWIMIKTOZOLNE-UHFFFAOYSA-N
MW437.59 g/mol
LogP9.20
Rot. Bonds4

About N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine

N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine (PubChem CID 156757141) has the molecular formula C33H27N and a molecular weight of 437.59 g/mol. Its IUPAC name is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine.

Molecular Properties

Compound NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine
PubChem CID156757141
Molecular FormulaC33H27N
Molecular Weight437.59 g/mol
Exact Mass437.21
IUPAC NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine
SMILESC=Cc1ccc(Nc2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12
InChIInChI=1S/C33H27N/c1-4-22-16-20-32(29-11-6-5-9-26(22)29)34-25-17-13-23(14-18-25)24-15-19-28-27-10-7-8-12-30(27)33(2,3)31(28)21-24/h4-21,34H,1H2,2-3H3
InChIKeyMKWIMIKTOZOLNE-UHFFFAOYSA-N
XLogP9.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.59
LogP ≤ 59.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;ethane
CID 143972766
N-[4-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]phenyl]-2-phenylaniline
CID 168764863
9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 134528915
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160556555
9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 59357506
4-[4-[2-(9,9-dimethylfluoren-2-yl)anilino]phenyl]-2-phenylaniline
CID 118682439
7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine
CID 142734200
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
N-(4-ethenylphenyl)-9,9-dimethylfluoren-2-amine
CID 163509163
9,9-dimethyl-N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-2-amine
CID 177113997
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine?
The IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine (CID 156757141) is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine.
What is the SMILES notation for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine?
The canonical SMILES for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine is C=Cc1ccc(Nc2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccccc12.
What is the InChIKey of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine?
The InChIKey is MKWIMIKTOZOLNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27N/c1-4-22-16-20-32(29-11-6-5-9-26(22)29)34-25-17-13-23(14-18-25)24-15-19-28-27-10-7-8-12-30(27)33(2,3)31(28)21-24/h4-21,34H,1H2,2-3H3.
What are the key properties of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine?
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine has a molecular weight of 437.59 g/mol, XLogP of 9.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine is sourced from PubChem (CID 156757141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).