5-cyclopropyl-3-methoxy-1,2,4-triazine

C7H9N3O — CID 3053039

IUPAC5-cyclopropyl-3-methoxy-1,2,4-triazine
SMILESCOc1nncc(C2CC2)n1
InChIInChI=1S/C7H9N3O/c1-11-7-9-6(4-8-10-7)5-2-3-5/h4-5H,2-3H2,1H3
InChIKeyBGCPJNDJZNEUQX-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.76
Rot. Bonds2

About 5-cyclopropyl-3-methoxy-1,2,4-triazine

5-cyclopropyl-3-methoxy-1,2,4-triazine (PubChem CID 3053039) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 5-cyclopropyl-3-methoxy-1,2,4-triazine.

Molecular Properties

Compound Name5-cyclopropyl-3-methoxy-1,2,4-triazine
PubChem CID3053039
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name5-cyclopropyl-3-methoxy-1,2,4-triazine
SMILESCOc1nncc(C2CC2)n1
InChIInChI=1S/C7H9N3O/c1-11-7-9-6(4-8-10-7)5-2-3-5/h4-5H,2-3H2,1H3
InChIKeyBGCPJNDJZNEUQX-UHFFFAOYSA-N
XLogP0.76
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

as-Triazine, 5-tert-butyl-3-methoxy-
CID 12853062
as-Triazine, 5-cyclopropyl-3-(methylthio)-
CID 3053036
5-(1-Fluoropropyl)-1,2,4-triazin-3-amine
CID 91206406
6-Propyl-1,2,4-triazine
CID 20527758
5-Propan-2-yl-1,2,4-triazine
CID 20700907
5-Propan-2-yl-1,2,4-triazin-3-amine
CID 21138965
6-Propan-2-yl-1,2,4-triazine
CID 23570579
3,5-Di(propan-2-yl)-1,2,4-triazine
CID 57538947
3-(2-Methylpropyl)-5-propan-2-yl-1,2,4-triazine
CID 57708537
5-(2-Methylpropyl)-3-propan-2-yl-1,2,4-triazine
CID 57708538
3-Methyl-5-propan-2-yl-1,2,4-triazine
CID 57708540
5-Pentyl-1,2,4-triazin-3-amine
CID 67377570

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-methoxy-1,2,4-triazine?
The IUPAC name of 5-cyclopropyl-3-methoxy-1,2,4-triazine (CID 3053039) is 5-cyclopropyl-3-methoxy-1,2,4-triazine.
What is the SMILES notation for 5-cyclopropyl-3-methoxy-1,2,4-triazine?
The canonical SMILES for 5-cyclopropyl-3-methoxy-1,2,4-triazine is COc1nncc(C2CC2)n1.
What is the InChIKey of 5-cyclopropyl-3-methoxy-1,2,4-triazine?
The InChIKey is BGCPJNDJZNEUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-11-7-9-6(4-8-10-7)5-2-3-5/h4-5H,2-3H2,1H3.
What are the key properties of 5-cyclopropyl-3-methoxy-1,2,4-triazine?
5-cyclopropyl-3-methoxy-1,2,4-triazine has a molecular weight of 151.17 g/mol, XLogP of 0.76, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-methoxy-1,2,4-triazine is sourced from PubChem (CID 3053039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).