3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine

C29H21N — CID 175536333

IUPAC3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine
SMILESNc1c2c(cc(-c3cccc4ccccc34)c1-c1ccccc1)-c1ccccc1C2
InChIInChI=1S/C29H21N/c30-29-27-17-21-12-5-7-15-23(21)25(27)18-26(28(29)20-10-2-1-3-11-20)24-16-8-13-19-9-4-6-14-22(19)24/h1-16,18H,17,30H2
InChIKeyTZJPNWTWRYKBAC-UHFFFAOYSA-N
MW383.49 g/mol
LogP7.33
Rot. Bonds2

About 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine

3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine (PubChem CID 175536333) has the molecular formula C29H21N and a molecular weight of 383.49 g/mol. Its IUPAC name is 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine.

Molecular Properties

Compound Name3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine
PubChem CID175536333
Molecular FormulaC29H21N
Molecular Weight383.49 g/mol
Exact Mass383.17
IUPAC Name3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine
SMILESNc1c2c(cc(-c3cccc4ccccc34)c1-c1ccccc1)-c1ccccc1C2
InChIInChI=1S/C29H21N/c30-29-27-17-21-12-5-7-15-23(21)25(27)18-26(28(29)20-10-2-1-3-11-20)24-16-8-13-19-9-4-6-14-22(19)24/h1-16,18H,17,30H2
InChIKeyTZJPNWTWRYKBAC-UHFFFAOYSA-N
XLogP7.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.49
LogP ≤ 57.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-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

5-naphthalen-1-yl-11H-benzo[a]fluorene
CID 161363694
9-[3-(9H-fluoren-1-yl)phenyl]-10-naphthalen-1-ylanthracene
CID 143848200
1-naphthalen-1-yl-11H-benzo[a]fluorene
CID 157136460
1-(3-methyl-4-phenylnaphthalen-2-yl)-9H-fluorene
CID 87557291
1-(9H-fluoren-1-yl)-2-naphthalen-1-yl-3-phenylanthracene
CID 141372306
1-[2-(2,3-diphenyl-9H-fluoren-1-yl)ethenyl]-2,3-diphenyl-9H-fluorene
CID 150549233
1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene
CID 150323539
3,4-dinaphthalen-1-yl-2-phenylaniline
CID 174903856
5-(7,10-diphenylfluoranthen-8-yl)naphthalen-1-amine
CID 166868480
1-(9H-fluoren-1-yl)-2,3,4-triphenyl-9H-fluorene
CID 150664526
2,3-dinaphthalen-1-yl-1-phenylanthracene
CID 151512335
19-[3-(3,5-diphenylphenyl)phenyl]pentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaene
CID 123937708

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine?
The IUPAC name of 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine (CID 175536333) is 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine.
What is the SMILES notation for 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine?
The canonical SMILES for 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine is Nc1c2c(cc(-c3cccc4ccccc34)c1-c1ccccc1)-c1ccccc1C2.
What is the InChIKey of 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine?
The InChIKey is TZJPNWTWRYKBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H21N/c30-29-27-17-21-12-5-7-15-23(21)25(27)18-26(28(29)20-10-2-1-3-11-20)24-16-8-13-19-9-4-6-14-22(19)24/h1-16,18H,17,30H2.
What are the key properties of 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine?
3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine has a molecular weight of 383.49 g/mol, XLogP of 7.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-1-yl-2-phenyl-9H-fluoren-1-amine is sourced from PubChem (CID 175536333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).