2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine

C6H8ClN3O2 — CID 19010699

IUPAC2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(OC)n1
InChIInChI=1S/C6H8ClN3O2/c1-3-12-6-9-4(7)8-5(10-6)11-2/h3H2,1-2H3
InChIKeyOPVNAHOSWGYLCE-UHFFFAOYSA-N
MW189.60 g/mol
LogP0.93
Rot. Bonds3

About 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine

2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine (PubChem CID 19010699) has the molecular formula C6H8ClN3O2 and a molecular weight of 189.60 g/mol. Its IUPAC name is 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine
PubChem CID19010699
Molecular FormulaC6H8ClN3O2
Molecular Weight189.60 g/mol
Exact Mass189.03
IUPAC Name2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(OC)n1
InChIInChI=1S/C6H8ClN3O2/c1-3-12-6-9-4(7)8-5(10-6)11-2/h3H2,1-2H3
InChIKeyOPVNAHOSWGYLCE-UHFFFAOYSA-N
XLogP0.93
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.60
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine with MolForge

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

Launch Full Analysis

Related Compounds

2-Chloro-4,6-dimethoxy-1,3,5-triazine
CID 18450
s-Triazine, 4,6-diamino-2-ethoxy-
CID 17802
2-Butoxy-4,6-dichloro-1,3,5-triazine
CID 26302
2,4,6-Triethoxy-1,3,5-triazine
CID 13440
2,4-Dichloro-6-isopropoxy-1,3,5-triazine
CID 23154
2,4-Dichloro-6-ethoxy-1,3,5-triazine
CID 29035
Acetonitrile, 2,2'-((6-chloro-1,3,5-triazine-2,4-diyl)bis(oxy))bis-
CID 3071535
2,4-Dichloro-6-propoxy-1,3,5-triazine
CID 33570
2-Chloro-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 53342808
2-Chloro-4,6-diethoxy-1,3,5-triazine
CID 35649
2,4,6-Tris(2-chloroethoxy)-1,3,5-triazine
CID 13742
2,4,6-Tributoxy-1,3,5-triazine
CID 29832

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine?
The IUPAC name of 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine (CID 19010699) is 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine is CCOc1nc(Cl)nc(OC)n1.
What is the InChIKey of 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine?
The InChIKey is OPVNAHOSWGYLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3O2/c1-3-12-6-9-4(7)8-5(10-6)11-2/h3H2,1-2H3.
What are the key properties of 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine?
2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine has a molecular weight of 189.60 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-ethoxy-6-methoxy-1,3,5-triazine is sourced from PubChem (CID 19010699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).