N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine

C7H12N4O — CID 27858

IUPACN-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(C)nc(OC)n1
InChIInChI=1S/C7H12N4O/c1-4-8-6-9-5(2)10-7(11-6)12-3/h4H2,1-3H3,(H,8,9,10,11)
InChIKeyOYUFSQBBGSLPTL-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.62
Rot. Bonds3

About N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine

N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine (PubChem CID 27858) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine
PubChem CID27858
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC NameN-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(C)nc(OC)n1
InChIInChI=1S/C7H12N4O/c1-4-8-6-9-5(2)10-7(11-6)12-3/h4H2,1-3H3,(H,8,9,10,11)
InChIKeyOYUFSQBBGSLPTL-UHFFFAOYSA-N
XLogP0.62
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine (CID 27858) is N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine is CCNc1nc(C)nc(OC)n1.
What is the InChIKey of N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is OYUFSQBBGSLPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-4-8-6-9-5(2)10-7(11-6)12-3/h4H2,1-3H3,(H,8,9,10,11).
What are the key properties of N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine?
N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 168.20 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methoxy-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 27858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).