CID 66916636

C10H9LiNO — CID 66916636

IUPAC—
SMILESCc1ccc2cccc(O)c2n1.[Li]
InChIInChI=1S/C10H9NO.Li/c1-7-5-6-8-3-2-4-9(12)10(8)11-7;/h2-6,12H,1H3;
InChIKeyARBJJQCMNJWEBJ-UHFFFAOYSA-N
MW166.13 g/mol
LogP1.87
Rot. Bonds

About CID 66916636

CID 66916636 (PubChem CID 66916636) has the molecular formula C10H9LiNO and a molecular weight of 166.13 g/mol.

Molecular Properties

Compound NameCID 66916636
PubChem CID66916636
Molecular FormulaC10H9LiNO
Molecular Weight166.13 g/mol
Exact Mass166.08
IUPAC Name—
SMILESCc1ccc2cccc(O)c2n1.[Li]
InChIInChI=1S/C10H9NO.Li/c1-7-5-6-8-3-2-4-9(12)10(8)11-7;/h2-6,12H,1H3;
InChIKeyARBJJQCMNJWEBJ-UHFFFAOYSA-N
XLogP1.87
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.13
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze CID 66916636 with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 66916636?
The IUPAC name of CID 66916636 (CID 66916636) is not available.
What is the SMILES notation for CID 66916636?
The canonical SMILES for CID 66916636 is Cc1ccc2cccc(O)c2n1.[Li].
What is the InChIKey of CID 66916636?
The InChIKey is ARBJJQCMNJWEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO.Li/c1-7-5-6-8-3-2-4-9(12)10(8)11-7;/h2-6,12H,1H3;.
What are the key properties of CID 66916636?
CID 66916636 has a molecular weight of 166.13 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66916636 is sourced from PubChem (CID 66916636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).