2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol

C10H16ClN3O — CID 133381524

IUPAC2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol
SMILESCCc1c(Cl)nc(C)nc1N(C)CCO
InChIInChI=1S/C10H16ClN3O/c1-4-8-9(11)12-7(2)13-10(8)14(3)5-6-15/h15H,4-6H2,1-3H3
InChIKeyGFADIMHCSUYVRZ-UHFFFAOYSA-N
MW229.71 g/mol
LogP1.43
Rot. Bonds4

About 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol

2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol (PubChem CID 133381524) has the molecular formula C10H16ClN3O and a molecular weight of 229.71 g/mol. Its IUPAC name is 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol.

Molecular Properties

Compound Name2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol
PubChem CID133381524
Molecular FormulaC10H16ClN3O
Molecular Weight229.71 g/mol
Exact Mass229.10
IUPAC Name2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol
SMILESCCc1c(Cl)nc(C)nc1N(C)CCO
InChIInChI=1S/C10H16ClN3O/c1-4-8-9(11)12-7(2)13-10(8)14(3)5-6-15/h15H,4-6H2,1-3H3
InChIKeyGFADIMHCSUYVRZ-UHFFFAOYSA-N
XLogP1.43
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol?
The IUPAC name of 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol (CID 133381524) is 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol.
What is the SMILES notation for 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol?
The canonical SMILES for 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol is CCc1c(Cl)nc(C)nc1N(C)CCO.
What is the InChIKey of 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol?
The InChIKey is GFADIMHCSUYVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3O/c1-4-8-9(11)12-7(2)13-10(8)14(3)5-6-15/h15H,4-6H2,1-3H3.
What are the key properties of 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol?
2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol has a molecular weight of 229.71 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-5-ethyl-2-methylpyrimidin-4-yl)-methylamino]ethanol is sourced from PubChem (CID 133381524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).