CID 102206658

C11H15N4O2 — CID 102206658

IUPAC—
SMILESCOc1ccc([C]2NN(C)C(=O)N(C)N2)cc1
InChIInChI=1S/C11H15N4O2/c1-14-11(16)15(2)13-10(12-14)8-4-6-9(17-3)7-5-8/h4-7,12-13H,1-3H3
InChIKeyAWFKZZFLFGAPOK-UHFFFAOYSA-N
MW235.27 g/mol
LogP0.54
Rot. Bonds2

About CID 102206658

CID 102206658 (PubChem CID 102206658) has the molecular formula C11H15N4O2 and a molecular weight of 235.27 g/mol.

Molecular Properties

Compound NameCID 102206658
PubChem CID102206658
Molecular FormulaC11H15N4O2
Molecular Weight235.27 g/mol
Exact Mass235.12
IUPAC Name—
SMILESCOc1ccc([C]2NN(C)C(=O)N(C)N2)cc1
InChIInChI=1S/C11H15N4O2/c1-14-11(16)15(2)13-10(12-14)8-4-6-9(17-3)7-5-8/h4-7,12-13H,1-3H3
InChIKeyAWFKZZFLFGAPOK-UHFFFAOYSA-N
XLogP0.54
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze CID 102206658 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 102206658?
The IUPAC name of CID 102206658 (CID 102206658) is not available.
What is the SMILES notation for CID 102206658?
The canonical SMILES for CID 102206658 is COc1ccc([C]2NN(C)C(=O)N(C)N2)cc1.
What is the InChIKey of CID 102206658?
The InChIKey is AWFKZZFLFGAPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N4O2/c1-14-11(16)15(2)13-10(12-14)8-4-6-9(17-3)7-5-8/h4-7,12-13H,1-3H3.
What are the key properties of CID 102206658?
CID 102206658 has a molecular weight of 235.27 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102206658 is sourced from PubChem (CID 102206658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).