2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine

C8H13N3O — CID 58059709

IUPAC2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine
SMILESCOc1nc(C)nc(C(C)C)n1
InChIInChI=1S/C8H13N3O/c1-5(2)7-9-6(3)10-8(11-7)12-4/h5H,1-4H3
InChIKeyOUPDHQRMZLYLSZ-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.31
Rot. Bonds2

About 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine

2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine (PubChem CID 58059709) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine
PubChem CID58059709
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine
SMILESCOc1nc(C)nc(C(C)C)n1
InChIInChI=1S/C8H13N3O/c1-5(2)7-9-6(3)10-8(11-7)12-4/h5H,1-4H3
InChIKeyOUPDHQRMZLYLSZ-UHFFFAOYSA-N
XLogP1.31
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 69701
4-Cyclopropyl-6-methoxy-1,3,5-triazin-2-amine
CID 2726591
1,3,5-Triazin-2-amine, 4-methoxy-6-propyl-
CID 199263
2,4,6-Triethyltriazine
CID 13889
N,N,4-Triethyl-6-methoxy-1,3,5-triazin-2-amine
CID 199902
N,N-Diethyl-4-methoxy-6-propyl-1,3,5-triazin-2-amine
CID 199908
4-Methyl-6-(propan-2-yl)-1,3,5-triazin-2-amine
CID 45092657
1,3,5-Triazine, 2,4-dimethoxy-6-methyl-
CID 19904
4-Tert-butyl-6-methoxy-1,3,5-triazin-2-amine
CID 698866
2-Ethyl-4,6-dimethoxy-1,3,5-triazine
CID 12809
2,4,6-Tri(propan-2-yl)-1,3,5-triazine
CID 32829
2,4-Dimethoxy-6-propan-2-yl-1,3,5-triazine
CID 86053141

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine?
The IUPAC name of 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine (CID 58059709) is 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine.
What is the SMILES notation for 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine?
The canonical SMILES for 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine is COc1nc(C)nc(C(C)C)n1.
What is the InChIKey of 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine?
The InChIKey is OUPDHQRMZLYLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(2)7-9-6(3)10-8(11-7)12-4/h5H,1-4H3.
What are the key properties of 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine?
2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine has a molecular weight of 167.21 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-methyl-6-propan-2-yl-1,3,5-triazine is sourced from PubChem (CID 58059709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).