4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine

C7H12N4O — CID 791291

IUPAC4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(C)nc(NC)n1
InChIInChI=1S/C7H12N4O/c1-4-12-7-10-5(2)9-6(8-3)11-7/h4H2,1-3H3,(H,8,9,10,11)
InChIKeyRTHVRVKIJCPJDU-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.62
Rot. Bonds3

About 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine

4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine (PubChem CID 791291) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine
PubChem CID791291
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC Name4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(C)nc(NC)n1
InChIInChI=1S/C7H12N4O/c1-4-12-7-10-5(2)9-6(8-3)11-7/h4H2,1-3H3,(H,8,9,10,11)
InChIKeyRTHVRVKIJCPJDU-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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Related Compounds

2-Amino-4-methoxy-6-methyl-1,3,5-triazine
CID 15466
1,3,5-Triazin-2-amine, 4-methoxy-N,6-dimethyl-
CID 160779
4-Ethyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 199901
4-Ethoxy-6-methyl-1,3,5-triazin-2-amine
CID 77490
4-Ethoxy-N-ethyl-6-methyl-1,3,5-triazin-2-amine
CID 21311
1,3,5-Triazin-2-amine, 4-butoxy-N-ethyl-6-methyl-
CID 21312
N,4-Diethyl-6-methoxy-1,3,5-triazin-2-amine
CID 21313
4-Ethoxy-N,6-diethyl-1,3,5-triazin-2-amine
CID 23295
1,3,5-Triazin-2-amine, 4-ethoxy-6-ethyl-
CID 121205
4-Ethoxy-6-ethyl-N-methyl-1,3,5-triazin-2-amine
CID 201842
1,3,5-Triazin-2-amine, 4-(2-methoxyethoxy)-6-methyl-
CID 3044260
1,3,5-Triazin-2-amine, 4-(chloromethyl)-6-ethoxy-N-ethyl-
CID 199907

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine (CID 791291) is 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine is CCOc1nc(C)nc(NC)n1.
What is the InChIKey of 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is RTHVRVKIJCPJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-4-12-7-10-5(2)9-6(8-3)11-7/h4H2,1-3H3,(H,8,9,10,11).
What are the key properties of 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine?
4-ethoxy-N,6-dimethyl-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 4-ethoxy-N,6-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 791291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).