CID 66760372

C21H16Na2 — CID 66760372

IUPAC—
SMILES[Na].[Na].c1ccc2c(Cc3cccc4ccccc34)cccc2c1
InChIInChI=1S/C21H16.2Na/c1-3-13-20-16(7-1)9-5-11-18(20)15-19-12-6-10-17-8-2-4-14-21(17)19;;/h1-14H,15H2;;
InChIKeyDFLIJRKCOYCHBU-UHFFFAOYSA-N
MW314.34 g/mol
LogP4.82
Rot. Bonds2

About CID 66760372

CID 66760372 (PubChem CID 66760372) has the molecular formula C21H16Na2 and a molecular weight of 314.34 g/mol.

Molecular Properties

Compound NameCID 66760372
PubChem CID66760372
Molecular FormulaC21H16Na2
Molecular Weight314.34 g/mol
Exact Mass314.10
IUPAC Name—
SMILES[Na].[Na].c1ccc2c(Cc3cccc4ccccc34)cccc2c1
InChIInChI=1S/C21H16.2Na/c1-3-13-20-16(7-1)9-5-11-18(20)15-19-12-6-10-17-8-2-4-14-21(17)19;;/h1-14H,15H2;;
InChIKeyDFLIJRKCOYCHBU-UHFFFAOYSA-N
XLogP4.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze CID 66760372 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

CID 57419547
CID 57419547
1-methyl-4-[[4-(naphthalen-1-ylmethyl)naphthalen-1-yl]methyl]naphthalene
CID 123365008
2-(naphthalen-1-ylmethyl)naphthalen-1-ol
CID 15617878
3-(naphthalen-1-ylmethyl)-1-benzofuran
CID 132539369
1-benzylnaphthalene;N-methylmethanamine
CID 70612820
2-(naphthalen-1-ylmethyl)benzenesulfonamide
CID 69182114
1-[(4-fluorophenyl)methyl]naphthalene
CID 11118033
N-methyl-1-naphthalen-1-ylmethanamine
CID 69403999
2-hydroxy-6-(naphthalen-1-ylmethyl)benzonitrile
CID 10801253
2-(naphthalen-1-ylmethyl)thiophene
CID 23454862
5-(naphthalen-1-ylmethyl)benzene-1,3-diol
CID 10658318
azane;1-ethylnaphthalene
CID 19048185

Frequently Asked Questions

What is the IUPAC name of CID 66760372?
The IUPAC name of CID 66760372 (CID 66760372) is not available.
What is the SMILES notation for CID 66760372?
The canonical SMILES for CID 66760372 is [Na].[Na].c1ccc2c(Cc3cccc4ccccc34)cccc2c1.
What is the InChIKey of CID 66760372?
The InChIKey is DFLIJRKCOYCHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16.2Na/c1-3-13-20-16(7-1)9-5-11-18(20)15-19-12-6-10-17-8-2-4-14-21(17)19;;/h1-14H,15H2;;.
What are the key properties of CID 66760372?
CID 66760372 has a molecular weight of 314.34 g/mol, XLogP of 4.82, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66760372 is sourced from PubChem (CID 66760372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).