2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol

C11H20N4O2 — CID 80825941

IUPAC2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol
SMILESCCNc1ncnc(NCCOCCO)c1C
InChIInChI=1S/C11H20N4O2/c1-3-12-10-9(2)11(15-8-14-10)13-4-6-17-7-5-16/h8,16H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyFTMUELKNCBAOCO-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.64
Rot. Bonds8

About 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol

2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol (PubChem CID 80825941) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol
PubChem CID80825941
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol
SMILESCCNc1ncnc(NCCOCCO)c1C
InChIInChI=1S/C11H20N4O2/c1-3-12-10-9(2)11(15-8-14-10)13-4-6-17-7-5-16/h8,16H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyFTMUELKNCBAOCO-UHFFFAOYSA-N
XLogP0.64
TPSA79.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[[2-tert-butyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol
CID 80985152
2-[3-[[5-bromo-6-(ethylamino)pyrimidin-4-yl]amino]propoxy]ethanol
CID 114172031
6-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]hexan-1-ol
CID 114009546
2-[2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 80918817
N-(2-butoxyethyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 80903690
2-[2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethoxy]ethanol
CID 28850882
6-N-ethyl-5-methyl-4-N-octylpyrimidine-4,6-diamine
CID 115565379
3-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]propanamide
CID 80787743
2-[2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]amino]ethoxy]ethanol
CID 80825947
2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol
CID 21002673
6-N-ethyl-5-methyl-4-N-[3-[methyl(propan-2-yl)amino]propyl]pyrimidine-4,6-diamine
CID 106042300
2-[2-(quinazolin-4-ylamino)ethoxy]ethanol
CID 7140376

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol?
The IUPAC name of 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol (CID 80825941) is 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol?
The canonical SMILES for 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol is CCNc1ncnc(NCCOCCO)c1C.
What is the InChIKey of 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol?
The InChIKey is FTMUELKNCBAOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-3-12-10-9(2)11(15-8-14-10)13-4-6-17-7-5-16/h8,16H,3-7H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol?
2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol has a molecular weight of 240.31 g/mol, XLogP of 0.64, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol is sourced from PubChem (CID 80825941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).