CID 175793556

C8H8ClKN — CID 175793556

IUPAC—
SMILESClc1cccnc1C1CC1.[K]
InChIInChI=1S/C8H8ClN.K/c9-7-2-1-5-10-8(7)6-3-4-6;/h1-2,5-6H,3-4H2;
InChIKeyCZZCWNHRXQCJLQ-UHFFFAOYSA-N
MW192.71 g/mol
LogP2.23
Rot. Bonds1

About CID 175793556

CID 175793556 (PubChem CID 175793556) has the molecular formula C8H8ClKN and a molecular weight of 192.71 g/mol.

Molecular Properties

Compound NameCID 175793556
PubChem CID175793556
Molecular FormulaC8H8ClKN
Molecular Weight192.71 g/mol
Exact Mass192.00
IUPAC Name—
SMILESClc1cccnc1C1CC1.[K]
InChIInChI=1S/C8H8ClN.K/c9-7-2-1-5-10-8(7)6-3-4-6;/h1-2,5-6H,3-4H2;
InChIKeyCZZCWNHRXQCJLQ-UHFFFAOYSA-N
XLogP2.23
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.71
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze CID 175793556 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 175793556?
The IUPAC name of CID 175793556 (CID 175793556) is not available.
What is the SMILES notation for CID 175793556?
The canonical SMILES for CID 175793556 is Clc1cccnc1C1CC1.[K].
What is the InChIKey of CID 175793556?
The InChIKey is CZZCWNHRXQCJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN.K/c9-7-2-1-5-10-8(7)6-3-4-6;/h1-2,5-6H,3-4H2;.
What are the key properties of CID 175793556?
CID 175793556 has a molecular weight of 192.71 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175793556 is sourced from PubChem (CID 175793556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).