2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol

C11H21N5O2 — CID 20778491

IUPAC2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNCCOCCc1nc(C)nc(NCCO)n1
InChIInChI=1S/C11H21N5O2/c1-9-14-10(3-7-18-8-5-12-2)16-11(15-9)13-4-6-17/h12,17H,3-8H2,1-2H3,(H,13,14,15,16)
InChIKeySGFHKVLLUFBJOY-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.64
Rot. Bonds9

About 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol

2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 20778491) has the molecular formula C11H21N5O2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID20778491
Molecular FormulaC11H21N5O2
Molecular Weight255.32 g/mol
Exact Mass255.17
IUPAC Name2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNCCOCCc1nc(C)nc(NCCO)n1
InChIInChI=1S/C11H21N5O2/c1-9-14-10(3-7-18-8-5-12-2)16-11(15-9)13-4-6-17/h12,17H,3-8H2,1-2H3,(H,13,14,15,16)
InChIKeySGFHKVLLUFBJOY-UHFFFAOYSA-N
XLogP-0.64
TPSA92.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-Morpholino-6-propyl-1,3,5-triazin-2-yl)aminoethanol
CID 130928
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080120
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, (S)-
CID 3080129
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, (R)-
CID 3080130
1,3,5-Triazin-2-amine, N-(2-methoxyethyl)-4-(4-morpholinyl)-6-propyl-
CID 3080171
1,2-Propanediol, 3-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 158978
Ethanol, 2,2'-((4-(cyclopropylamino)-6-propyl-1,3,5-triazin-2-yl)imino)bis-, monohydrochloride
CID 3073350
1-Propanol, 3-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080118
1-Butanol, 4-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080119
2-Butanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080121
1-Butanol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080122
1-Propanol, 2-methyl-2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080123

Frequently Asked Questions

What is the IUPAC name of 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol (CID 20778491) is 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol is CNCCOCCc1nc(C)nc(NCCO)n1.
What is the InChIKey of 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is SGFHKVLLUFBJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O2/c1-9-14-10(3-7-18-8-5-12-2)16-11(15-9)13-4-6-17/h12,17H,3-8H2,1-2H3,(H,13,14,15,16).
What are the key properties of 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 255.32 g/mol, XLogP of -0.64, 9 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-methyl-6-[2-[2-(methylamino)ethoxy]ethyl]-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 20778491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).