2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine

C12H21N5O2 — CID 80872901

IUPAC2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(OC2CCOCC2)n1
InChIInChI=1S/C12H21N5O2/c1-3-17(4-2)11-14-10(13)15-12(16-11)19-9-5-7-18-8-6-9/h9H,3-8H2,1-2H3,(H2,13,14,15,16)
InChIKeyDBMXKTJLNAMHJC-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.86
Rot. Bonds5

About 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine

2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine (PubChem CID 80872901) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine
PubChem CID80872901
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(OC2CCOCC2)n1
InChIInChI=1S/C12H21N5O2/c1-3-17(4-2)11-14-10(13)15-12(16-11)19-9-5-7-18-8-6-9/h9H,3-8H2,1-2H3,(H2,13,14,15,16)
InChIKeyDBMXKTJLNAMHJC-UHFFFAOYSA-N
XLogP0.86
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

2-N-(cyclobutylmethyl)-2-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 107403037
2-N,2-N-dimethyl-6-(4-methylcyclohexyl)oxy-1,3,5-triazine-2,4-diamine
CID 80858525
6-cycloheptyloxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80871374
4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
CID 80873023
2-N-ethyl-6-methoxy-2-N-(oxolan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80799814
4-cycloheptyloxy-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 80913301
6-(4,4-dimethylcyclohexyl)oxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 114342953
2-N-(cyclopropylmethyl)-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80839965
2-N,2-N-diethyl-6-(2-methylbutan-2-yloxy)-1,3,5-triazine-2,4-diamine
CID 80862184
N,N-diethyl-4-hydrazinyl-6-(3-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
CID 80906831
2-N-cyclopropyl-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80773987
2-N,2-N-diethyl-6-(3-methoxypropoxy)-1,3,5-triazine-2,4-diamine
CID 80865247

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine (CID 80872901) is 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(N)nc(OC2CCOCC2)n1.
What is the InChIKey of 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine?
The InChIKey is DBMXKTJLNAMHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-3-17(4-2)11-14-10(13)15-12(16-11)19-9-5-7-18-8-6-9/h9H,3-8H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine?
2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine has a molecular weight of 267.33 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80872901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).