6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline

C14H17ClN4O — CID 24759624

IUPAC6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline
SMILESCOc1nc2cc(Cl)ccc2nc1N1CCN(C)CC1
InChIInChI=1S/C14H17ClN4O/c1-18-5-7-19(8-6-18)13-14(20-2)17-12-9-10(15)3-4-11(12)16-13/h3-4,9H,5-8H2,1-2H3
InChIKeyQMNBRYSQAGUIKX-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.04
Rot. Bonds2

About 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline

6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline (PubChem CID 24759624) has the molecular formula C14H17ClN4O and a molecular weight of 292.77 g/mol. Its IUPAC name is 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline.

Molecular Properties

Compound Name6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline
PubChem CID24759624
Molecular FormulaC14H17ClN4O
Molecular Weight292.77 g/mol
Exact Mass292.11
IUPAC Name6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline
SMILESCOc1nc2cc(Cl)ccc2nc1N1CCN(C)CC1
InChIInChI=1S/C14H17ClN4O/c1-18-5-7-19(8-6-18)13-14(20-2)17-12-9-10(15)3-4-11(12)16-13/h3-4,9H,5-8H2,1-2H3
InChIKeyQMNBRYSQAGUIKX-UHFFFAOYSA-N
XLogP2.04
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline 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 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline?
The IUPAC name of 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline (CID 24759624) is 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline.
What is the SMILES notation for 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline?
The canonical SMILES for 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline is COc1nc2cc(Cl)ccc2nc1N1CCN(C)CC1.
What is the InChIKey of 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline?
The InChIKey is QMNBRYSQAGUIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O/c1-18-5-7-19(8-6-18)13-14(20-2)17-12-9-10(15)3-4-11(12)16-13/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline?
6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline has a molecular weight of 292.77 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-methoxy-2-(4-methylpiperazin-1-yl)quinoxaline is sourced from PubChem (CID 24759624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).