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

C10H19N5O — CID 19135193

IUPAC2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol
SMILESCCNc1ncnc(N(CC)CCO)c1N
InChIInChI=1S/C10H19N5O/c1-3-12-9-8(11)10(14-7-13-9)15(4-2)5-6-16/h7,16H,3-6,11H2,1-2H3,(H,12,13,14)
InChIKeyXDVUTXQWCXMXER-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.31
Rot. Bonds6

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

2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol (PubChem CID 19135193) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol.

Molecular Properties

Compound Name2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol
PubChem CID19135193
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol
SMILESCCNc1ncnc(N(CC)CCO)c1N
InChIInChI=1S/C10H19N5O/c1-3-12-9-8(11)10(14-7-13-9)15(4-2)5-6-16/h7,16H,3-6,11H2,1-2H3,(H,12,13,14)
InChIKeyXDVUTXQWCXMXER-UHFFFAOYSA-N
XLogP0.31
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol?
The IUPAC name of 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol (CID 19135193) is 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol.
What is the SMILES notation for 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol?
The canonical SMILES for 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol is CCNc1ncnc(N(CC)CCO)c1N.
What is the InChIKey of 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol?
The InChIKey is XDVUTXQWCXMXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-3-12-9-8(11)10(14-7-13-9)15(4-2)5-6-16/h7,16H,3-6,11H2,1-2H3,(H,12,13,14).
What are the key properties of 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol?
2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol has a molecular weight of 225.30 g/mol, XLogP of 0.31, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-amino-6-(ethylamino)pyrimidin-4-yl]-ethylamino]ethanol is sourced from PubChem (CID 19135193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).