2-naphthalen-1-yl-2-phenyladamantane

C26H26 — CID 162698485

IUPAC2-naphthalen-1-yl-2-phenyladamantane
SMILESc1ccc(C2(c3cccc4ccccc34)C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C26H26/c1-2-9-21(10-3-1)26(22-14-18-13-19(16-22)17-23(26)15-18)25-12-6-8-20-7-4-5-11-24(20)25/h1-12,18-19,22-23H,13-17H2
InChIKeyCCPIQKHNFDKZHT-UHFFFAOYSA-N
MW338.49 g/mol
LogP6.58
Rot. Bonds2

About 2-naphthalen-1-yl-2-phenyladamantane

2-naphthalen-1-yl-2-phenyladamantane (PubChem CID 162698485) has the molecular formula C26H26 and a molecular weight of 338.49 g/mol. Its IUPAC name is 2-naphthalen-1-yl-2-phenyladamantane.

Molecular Properties

Compound Name2-naphthalen-1-yl-2-phenyladamantane
PubChem CID162698485
Molecular FormulaC26H26
Molecular Weight338.49 g/mol
Exact Mass338.20
IUPAC Name2-naphthalen-1-yl-2-phenyladamantane
SMILESc1ccc(C2(c3cccc4ccccc34)C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C26H26/c1-2-9-21(10-3-1)26(22-14-18-13-19(16-22)17-23(26)15-18)25-12-6-8-20-7-4-5-11-24(20)25/h1-12,18-19,22-23H,13-17H2
InChIKeyCCPIQKHNFDKZHT-UHFFFAOYSA-N
XLogP6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.49
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-naphthalen-1-yl-2-phenyladamantane 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

2-naphthalen-1-yl-2-naphthalen-2-yladamantane
CID 162698501
spiro[adamantane-2,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]
CID 162698475
2-(9',9'-diphenylspiro[adamantane-2,10'-anthracene]-2'-yl)-4,6-dinaphthalen-1-yl-1,3,5-triazine
CID 166018058
4'-(10-naphthalen-1-ylanthracen-9-yl)spiro[adamantane-2,11'-benzo[b]fluorene]
CID 168808869
8'-(10-naphthalen-1-ylanthracen-9-yl)spiro[adamantane-2,7'-benzo[c]fluorene]
CID 168808880
9,9-dimethyl-N-naphthalen-1-yl-N-[4-[2-[4-(N-phenylanilino)phenyl]-2-adamantyl]phenyl]fluoren-2-amine
CID 168744605
N-naphthalen-1-yl-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393699
N-(4-naphthalen-1-ylphenyl)-4-phenyl-N-[4-(4-spiro[adamantane-2,9'-fluorene]-1'-ylphenyl)phenyl]aniline
CID 156567903
2,2-bis(2-methylphenyl)adamantane
CID 173019574
N-naphthalen-1-yl-N-(4-phenylnaphthalen-1-yl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155399556
2-naphthalen-1-yl-4-(4-phenylphenyl)-6-spiro[adamantane-2,11'-benzo[b]fluorene]-9'-yl-1,3,5-triazine
CID 167353933
1-(2-naphthalen-2-yl-2-adamantyl)-9H-fluorene
CID 163601006

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-2-phenyladamantane?
The IUPAC name of 2-naphthalen-1-yl-2-phenyladamantane (CID 162698485) is 2-naphthalen-1-yl-2-phenyladamantane.
What is the SMILES notation for 2-naphthalen-1-yl-2-phenyladamantane?
The canonical SMILES for 2-naphthalen-1-yl-2-phenyladamantane is c1ccc(C2(c3cccc4ccccc34)C3CC4CC(C3)CC2C4)cc1.
What is the InChIKey of 2-naphthalen-1-yl-2-phenyladamantane?
The InChIKey is CCPIQKHNFDKZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26/c1-2-9-21(10-3-1)26(22-14-18-13-19(16-22)17-23(26)15-18)25-12-6-8-20-7-4-5-11-24(20)25/h1-12,18-19,22-23H,13-17H2.
What are the key properties of 2-naphthalen-1-yl-2-phenyladamantane?
2-naphthalen-1-yl-2-phenyladamantane has a molecular weight of 338.49 g/mol, XLogP of 6.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-2-phenyladamantane is sourced from PubChem (CID 162698485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).