6-ethyl-4-methyl-4,5-dihydrotriazine

C6H11N3 — CID 123764758

IUPAC6-ethyl-4-methyl-4,5-dihydrotriazine
SMILESCCC1=NN=NC(C)C1
InChIInChI=1S/C6H11N3/c1-3-6-4-5(2)7-9-8-6/h5H,3-4H2,1-2H3
InChIKeyHTWBZRYNMUKBRH-UHFFFAOYSA-N
MW125.17 g/mol
LogP2.00
Rot. Bonds1

About 6-ethyl-4-methyl-4,5-dihydrotriazine

6-ethyl-4-methyl-4,5-dihydrotriazine (PubChem CID 123764758) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 6-ethyl-4-methyl-4,5-dihydrotriazine.

Molecular Properties

Compound Name6-ethyl-4-methyl-4,5-dihydrotriazine
PubChem CID123764758
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name6-ethyl-4-methyl-4,5-dihydrotriazine
SMILESCCC1=NN=NC(C)C1
InChIInChI=1S/C6H11N3/c1-3-6-4-5(2)7-9-8-6/h5H,3-4H2,1-2H3
InChIKeyHTWBZRYNMUKBRH-UHFFFAOYSA-N
XLogP2.00
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2-[tris(4-ethyl-2,3-dihydroazet-2-yl)methyl]-2,3-dihydroazete
CID 58890537
5-ethyl-4-methyl-4H-triazole
CID 174053844
(3-ethyl-4,5-dihydro-1,2-oxazol-5-yl)methanol
CID 14143956
(1R)-1-[(5R)-3-ethyl-4,5-dihydro-1,2-oxazol-5-yl]ethanol
CID 15122206
2-amino-6-ethyl-4,5-dihydropyrimidin-4-ol
CID 123350880
(5R)-5-[(1S)-1-chloroethyl]-3-ethyl-4,5-dihydro-1,2-oxazole
CID 95242258
3-ethyl-5-methyl-4H-pyrazole
CID 59050127
1-[(5R)-3-ethyl-4,5-dihydro-1,2-oxazol-5-yl]-N-methylmethanamine
CID 51698766
1,2-diethyl-4,5-dimethylcyclohexene
CID 74022411
2-ethyl-5-methyl-3a,7a-dihydro-3H-pyrrolo[3,2-b]pyridine
CID 123268597
carbon dioxide;3-ethyl-5-(trifluoromethyl)-4,5-dihydro-1,2-oxazole
CID 158570874
5-ethyl-2-methyl-6H-1,3,4-thiadiazine
CID 145451894

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-methyl-4,5-dihydrotriazine?
The IUPAC name of 6-ethyl-4-methyl-4,5-dihydrotriazine (CID 123764758) is 6-ethyl-4-methyl-4,5-dihydrotriazine.
What is the SMILES notation for 6-ethyl-4-methyl-4,5-dihydrotriazine?
The canonical SMILES for 6-ethyl-4-methyl-4,5-dihydrotriazine is CCC1=NN=NC(C)C1.
What is the InChIKey of 6-ethyl-4-methyl-4,5-dihydrotriazine?
The InChIKey is HTWBZRYNMUKBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-6-4-5(2)7-9-8-6/h5H,3-4H2,1-2H3.
What are the key properties of 6-ethyl-4-methyl-4,5-dihydrotriazine?
6-ethyl-4-methyl-4,5-dihydrotriazine has a molecular weight of 125.17 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-methyl-4,5-dihydrotriazine is sourced from PubChem (CID 123764758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).