4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine

C9H14N4O2 — CID 80867582

IUPAC4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(OCC2CC2)n1
InChIInChI=1S/C9H14N4O2/c1-10-7-11-8(14-2)13-9(12-7)15-5-6-3-4-6/h6H,3-5H2,1-2H3,(H,10,11,12,13)
InChIKeyMZORUGXFAOQMHY-UHFFFAOYSA-N
MW210.24 g/mol
LogP0.71
Rot. Bonds5

About 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine

4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine (PubChem CID 80867582) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
PubChem CID80867582
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC)nc(OCC2CC2)n1
InChIInChI=1S/C9H14N4O2/c1-10-7-11-8(14-2)13-9(12-7)15-5-6-3-4-6/h6H,3-5H2,1-2H3,(H,10,11,12,13)
InChIKeyMZORUGXFAOQMHY-UHFFFAOYSA-N
XLogP0.71
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine (CID 80867582) is 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine is CNc1nc(OC)nc(OCC2CC2)n1.
What is the InChIKey of 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is MZORUGXFAOQMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-10-7-11-8(14-2)13-9(12-7)15-5-6-3-4-6/h6H,3-5H2,1-2H3,(H,10,11,12,13).
What are the key properties of 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 210.24 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80867582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).