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

C7H10ClN3O — CID 20796092

IUPAC2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(CC)n1
InChIInChI=1S/C7H10ClN3O/c1-3-5-9-6(8)11-7(10-5)12-4-2/h3-4H2,1-2H3
InChIKeyGWWGWFBDICLKLD-UHFFFAOYSA-N
MW187.63 g/mol
LogP1.49
Rot. Bonds3

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

2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine (PubChem CID 20796092) has the molecular formula C7H10ClN3O and a molecular weight of 187.63 g/mol. Its IUPAC name is 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine
PubChem CID20796092
Molecular FormulaC7H10ClN3O
Molecular Weight187.63 g/mol
Exact Mass187.05
IUPAC Name2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(CC)n1
InChIInChI=1S/C7H10ClN3O/c1-3-5-9-6(8)11-7(10-5)12-4-2/h3-4H2,1-2H3
InChIKeyGWWGWFBDICLKLD-UHFFFAOYSA-N
XLogP1.49
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Ethoxy-6-methyl-1,3,5-triazin-2-amine
CID 77490
4-Ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 69701
1,3,5-Triazin-2-amine, 4-ethoxy-6-ethyl-
CID 121205
1,3,5-Triazine-2-acetonitrile, 4-amino-6-ethoxy-
CID 199945
2-Ethyl-4,6-dimethoxy-1,3,5-triazine
CID 12809
2-Chloro-4,6-diethyl-1,3,5-triazine
CID 12795
2-Chloro-4-methoxy-6-methyl-1,3,5-triazine
CID 19392079
2-Ethyl-4-methoxy-6-methyl-1,3,5-triazine
CID 22082540
2-Chloro-4-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 20702269
2-Chloro-4-[2,2-difluoro-2-(2-fluoroethoxy)ethyl]-6-methyl-1,3,5-triazine
CID 157776703
2,4-Diethyl-6-methoxy-1,3,5-triazine
CID 91622538
4,6-Di-t-butyl-2-ethoxy-1,3,5-triazine
CID 129838350

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine?
The IUPAC name of 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine (CID 20796092) is 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine is CCOc1nc(Cl)nc(CC)n1.
What is the InChIKey of 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine?
The InChIKey is GWWGWFBDICLKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O/c1-3-5-9-6(8)11-7(10-5)12-4-2/h3-4H2,1-2H3.
What are the key properties of 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine?
2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine has a molecular weight of 187.63 g/mol, XLogP of 1.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-ethoxy-6-ethyl-1,3,5-triazine is sourced from PubChem (CID 20796092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).