2-chloro-4,6-diethyl-1,3,5-triazine

C7H10ClN3 — CID 12795

IUPAC2-chloro-4,6-diethyl-1,3,5-triazine
SMILESCCc1nc(Cl)nc(CC)n1
InChIInChI=1S/C7H10ClN3/c1-3-5-9-6(4-2)11-7(8)10-5/h3-4H2,1-2H3
InChIKeyXTLZSQZATHNMBX-UHFFFAOYSA-N
MW171.63 g/mol
LogP1.65
Rot. Bonds2

About 2-chloro-4,6-diethyl-1,3,5-triazine

2-chloro-4,6-diethyl-1,3,5-triazine (PubChem CID 12795) has the molecular formula C7H10ClN3 and a molecular weight of 171.63 g/mol. Its IUPAC name is 2-chloro-4,6-diethyl-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4,6-diethyl-1,3,5-triazine
PubChem CID12795
Molecular FormulaC7H10ClN3
Molecular Weight171.63 g/mol
Exact Mass171.06
IUPAC Name2-chloro-4,6-diethyl-1,3,5-triazine
SMILESCCc1nc(Cl)nc(CC)n1
InChIInChI=1S/C7H10ClN3/c1-3-5-9-6(4-2)11-7(8)10-5/h3-4H2,1-2H3
InChIKeyXTLZSQZATHNMBX-UHFFFAOYSA-N
XLogP1.65
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,3,5-Triazine, 2,4,6-trimethyl-
CID 13208
6-Ethyl-1,3,5-triazine-2,4-diamine
CID 13628
6-Propyl-1,3,5-triazine-2,4-diamine
CID 22252
2,4-Dichloro-6-methyl-1,3,5-triazine
CID 16083
2,4-Dichloro-6-(propan-2-yl)-1,3,5-triazine
CID 35648
2,4,6-Triethyltriazine
CID 13889
4-Chloro-6-(2-fluoropropan-2-yl)-1,3,5-triazin-2-amine
CID 11446828
4-Methyl-6-(propan-2-yl)-1,3,5-triazin-2-amine
CID 45092657
2,4,6-Tri(propan-2-yl)-1,3,5-triazine
CID 32829
2-Chloro-4-ethyl-6-propan-2-yl-1,3,5-triazine
CID 87676010
2,4-Dichloro-6-ethyl-1,3,5-triazine
CID 12776
2,4-Diethyl-1,3,5-triazine
CID 19194

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4,6-diethyl-1,3,5-triazine?
The IUPAC name of 2-chloro-4,6-diethyl-1,3,5-triazine (CID 12795) is 2-chloro-4,6-diethyl-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4,6-diethyl-1,3,5-triazine?
The canonical SMILES for 2-chloro-4,6-diethyl-1,3,5-triazine is CCc1nc(Cl)nc(CC)n1.
What is the InChIKey of 2-chloro-4,6-diethyl-1,3,5-triazine?
The InChIKey is XTLZSQZATHNMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3/c1-3-5-9-6(4-2)11-7(8)10-5/h3-4H2,1-2H3.
What are the key properties of 2-chloro-4,6-diethyl-1,3,5-triazine?
2-chloro-4,6-diethyl-1,3,5-triazine has a molecular weight of 171.63 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4,6-diethyl-1,3,5-triazine is sourced from PubChem (CID 12795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).