CID 59886573

C15H19Y- — CID 59886573

IUPAC—
SMILES[Y].c1ccc(CC23CC[C-](CC2)CC3)cc1
InChIInChI=1S/C15H19.Y/c1-2-4-14(5-3-1)12-15-9-6-13(7-10-15)8-11-15;/h1-5H,6-12H2;/q-1;
InChIKeyAHKJIXOQVAXNAW-UHFFFAOYSA-N
MW288.22 g/mol
LogP4.16
Rot. Bonds2

About CID 59886573

CID 59886573 (PubChem CID 59886573) has the molecular formula C15H19Y- and a molecular weight of 288.22 g/mol.

Molecular Properties

Compound NameCID 59886573
PubChem CID59886573
Molecular FormulaC15H19Y-
Molecular Weight288.22 g/mol
Exact Mass288.06
IUPAC Name—
SMILES[Y].c1ccc(CC23CC[C-](CC2)CC3)cc1
InChIInChI=1S/C15H19.Y/c1-2-4-14(5-3-1)12-15-9-6-13(7-10-15)8-11-15;/h1-5H,6-12H2;/q-1;
InChIKeyAHKJIXOQVAXNAW-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 59886573 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 59886573?
The IUPAC name of CID 59886573 (CID 59886573) is not available.
What is the SMILES notation for CID 59886573?
The canonical SMILES for CID 59886573 is [Y].c1ccc(CC23CC[C-](CC2)CC3)cc1.
What is the InChIKey of CID 59886573?
The InChIKey is AHKJIXOQVAXNAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19.Y/c1-2-4-14(5-3-1)12-15-9-6-13(7-10-15)8-11-15;/h1-5H,6-12H2;/q-1;.
What are the key properties of CID 59886573?
CID 59886573 has a molecular weight of 288.22 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59886573 is sourced from PubChem (CID 59886573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).