2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol

C10H17N3O — CID 61147655

IUPAC2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol
SMILESCCN(CCO)c1nc(C)cc(C)n1
InChIInChI=1S/C10H17N3O/c1-4-13(5-6-14)10-11-8(2)7-9(3)12-10/h7,14H,4-6H2,1-3H3
InChIKeyVMPDCCKLCGMHOZ-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.91
Rot. Bonds4

About 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol

2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol (PubChem CID 61147655) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol.

Molecular Properties

Compound Name2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol
PubChem CID61147655
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol
SMILESCCN(CCO)c1nc(C)cc(C)n1
InChIInChI=1S/C10H17N3O/c1-4-13(5-6-14)10-11-8(2)7-9(3)12-10/h7,14H,4-6H2,1-3H3
InChIKeyVMPDCCKLCGMHOZ-UHFFFAOYSA-N
XLogP0.91
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol?
The IUPAC name of 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol (CID 61147655) is 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol.
What is the SMILES notation for 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol?
The canonical SMILES for 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol is CCN(CCO)c1nc(C)cc(C)n1.
What is the InChIKey of 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol?
The InChIKey is VMPDCCKLCGMHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-4-13(5-6-14)10-11-8(2)7-9(3)12-10/h7,14H,4-6H2,1-3H3.
What are the key properties of 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol?
2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol has a molecular weight of 195.27 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol is sourced from PubChem (CID 61147655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).