4-(methoxymethyl)-1,3,5-triazin-2-amine

C5H8N4O — CID 54305662

IUPAC4-(methoxymethyl)-1,3,5-triazin-2-amine
SMILESCOCc1ncnc(N)n1
InChIInChI=1S/C5H8N4O/c1-10-2-4-7-3-8-5(6)9-4/h3H,2H2,1H3,(H2,6,7,8,9)
InChIKeySHHHVQXPPCSQKX-UHFFFAOYSA-N
MW140.15 g/mol
LogP-0.40
Rot. Bonds2

About 4-(methoxymethyl)-1,3,5-triazin-2-amine

4-(methoxymethyl)-1,3,5-triazin-2-amine (PubChem CID 54305662) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is 4-(methoxymethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(methoxymethyl)-1,3,5-triazin-2-amine
PubChem CID54305662
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC Name4-(methoxymethyl)-1,3,5-triazin-2-amine
SMILESCOCc1ncnc(N)n1
InChIInChI=1S/C5H8N4O/c1-10-2-4-7-3-8-5(6)9-4/h3H,2H2,1H3,(H2,6,7,8,9)
InChIKeySHHHVQXPPCSQKX-UHFFFAOYSA-N
XLogP-0.40
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-(methoxymethyl)-1,3,5-triazin-2-amine (CID 54305662) is 4-(methoxymethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(methoxymethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(methoxymethyl)-1,3,5-triazin-2-amine is COCc1ncnc(N)n1.
What is the InChIKey of 4-(methoxymethyl)-1,3,5-triazin-2-amine?
The InChIKey is SHHHVQXPPCSQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c1-10-2-4-7-3-8-5(6)9-4/h3H,2H2,1H3,(H2,6,7,8,9).
What are the key properties of 4-(methoxymethyl)-1,3,5-triazin-2-amine?
4-(methoxymethyl)-1,3,5-triazin-2-amine has a molecular weight of 140.15 g/mol, XLogP of -0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 54305662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).