7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine

C39H32N2 — CID 142734200

IUPAC7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine
SMILESC=Cc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(-c4ccc(Nc5cccc6ccccc56)cc4)cc3)ccc1-2
InChIInChI=1S/C39H32N2/c1-4-26-12-22-34-35-23-21-32(25-37(35)39(2,3)36(34)24-26)40-30-17-13-27(14-18-30)28-15-19-31(20-16-28)41-38-11-7-9-29-8-5-6-10-33(29)38/h4-25,40-41H,1H2,2-3H3
InChIKeyDEHZVROFNNHIRA-UHFFFAOYSA-N
MW528.70 g/mol
LogP10.94
Rot. Bonds6

About 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine

7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine (PubChem CID 142734200) has the molecular formula C39H32N2 and a molecular weight of 528.70 g/mol. Its IUPAC name is 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine.

Molecular Properties

Compound Name7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine
PubChem CID142734200
Molecular FormulaC39H32N2
Molecular Weight528.70 g/mol
Exact Mass528.26
IUPAC Name7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine
SMILESC=Cc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(-c4ccc(Nc5cccc6ccccc56)cc4)cc3)ccc1-2
InChIInChI=1S/C39H32N2/c1-4-26-12-22-34-35-23-21-32(25-37(35)39(2,3)36(34)24-26)40-30-17-13-27(14-18-30)28-15-19-31(20-16-28)41-38-11-7-9-29-8-5-6-10-33(29)38/h4-25,40-41H,1H2,2-3H3
InChIKeyDEHZVROFNNHIRA-UHFFFAOYSA-N
XLogP10.94
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500528.70
LogP ≤ 510.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-2-amine
CID 70891334
N-(4-ethenylphenyl)-9,9-dimethylfluoren-2-amine
CID 163509163
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-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-2-amine
CID 177113997
9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 59357506
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-ethenylnaphthalen-1-amine
CID 156757141
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-3-amine
CID 167230911
4-fluoro-N-phenylaniline;N-naphthalen-1-yl-9,9'-spirobi[fluorene]-2-amine;N-phenylaniline;N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 158216881
N-[4-[3-(9,9-dimethylfluoren-3-yl)-4-(4-phenylanilino)phenyl]-2-phenylphenyl]naphthalen-1-amine
CID 121343768
2-N,7-N-bis(2-anilinophenyl)-9,9-dimethylfluorene-2,7-diamine
CID 71080481
9,9-dimethyl-N-(4-naphtho[1,2-b][1]benzothiol-10-ylphenyl)fluoren-2-amine
CID 177121851

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine?
The IUPAC name of 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine (CID 142734200) is 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine.
What is the SMILES notation for 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine?
The canonical SMILES for 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine is C=Cc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(-c4ccc(Nc5cccc6ccccc56)cc4)cc3)ccc1-2.
What is the InChIKey of 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine?
The InChIKey is DEHZVROFNNHIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H32N2/c1-4-26-12-22-34-35-23-21-32(25-37(35)39(2,3)36(34)24-26)40-30-17-13-27(14-18-30)28-15-19-31(20-16-28)41-38-11-7-9-29-8-5-6-10-33(29)38/h4-25,40-41H,1H2,2-3H3.
What are the key properties of 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine?
7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine has a molecular weight of 528.70 g/mol, XLogP of 10.94, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-9,9-dimethyl-N-[4-[4-(naphthalen-1-ylamino)phenyl]phenyl]fluoren-2-amine is sourced from PubChem (CID 142734200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).