2-ethyl-3-methyl-1,3,5-triazepine

C7H11N3 — CID 89053427

IUPAC2-ethyl-3-methyl-1,3,5-triazepine
SMILESCCC1=NC=CN=CN1C
InChIInChI=1S/C7H11N3/c1-3-7-9-5-4-8-6-10(7)2/h4-6H,3H2,1-2H3
InChIKeyGCYQOYUDUPSPHK-UHFFFAOYSA-N
MW137.19 g/mol
LogP1.24
Rot. Bonds1

About 2-ethyl-3-methyl-1,3,5-triazepine

2-ethyl-3-methyl-1,3,5-triazepine (PubChem CID 89053427) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 2-ethyl-3-methyl-1,3,5-triazepine.

Molecular Properties

Compound Name2-ethyl-3-methyl-1,3,5-triazepine
PubChem CID89053427
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name2-ethyl-3-methyl-1,3,5-triazepine
SMILESCCC1=NC=CN=CN1C
InChIInChI=1S/C7H11N3/c1-3-7-9-5-4-8-6-10(7)2/h4-6H,3H2,1-2H3
InChIKeyGCYQOYUDUPSPHK-UHFFFAOYSA-N
XLogP1.24
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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N-ethenyl-N'-methyl-N-propylpropanimidamide
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N'-ethenyl-N,N-dimethylpropanimidamide
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N-ethenyl-N,N'-dimethylpropanimidamide
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N'-ethenyl-N-methyl-N-propylmethanimidamide
CID 141976003
N-ethenyl-N'-methyl-N-propylmethanimidamide
CID 141976013
N'-ethenyl-N-ethyl-N-methylpropanimidamide
CID 143693602
1,2-Dimethyl-1-propylimidazol-1-ium
CID 150356977
1-Propylideneimidazol-1-ium
CID 150360014
1,1,2-Triethylimidazol-1-ium
CID 154928101

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methyl-1,3,5-triazepine?
The IUPAC name of 2-ethyl-3-methyl-1,3,5-triazepine (CID 89053427) is 2-ethyl-3-methyl-1,3,5-triazepine.
What is the SMILES notation for 2-ethyl-3-methyl-1,3,5-triazepine?
The canonical SMILES for 2-ethyl-3-methyl-1,3,5-triazepine is CCC1=NC=CN=CN1C.
What is the InChIKey of 2-ethyl-3-methyl-1,3,5-triazepine?
The InChIKey is GCYQOYUDUPSPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-3-7-9-5-4-8-6-10(7)2/h4-6H,3H2,1-2H3.
What are the key properties of 2-ethyl-3-methyl-1,3,5-triazepine?
2-ethyl-3-methyl-1,3,5-triazepine has a molecular weight of 137.19 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methyl-1,3,5-triazepine is sourced from PubChem (CID 89053427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).