6-amino-1-(2-hydroxyethyl)pyrimidin-2-one

C6H9N3O2 — CID 56977468

IUPAC6-amino-1-(2-hydroxyethyl)pyrimidin-2-one
SMILESNc1ccnc(=O)n1CCO
InChIInChI=1S/C6H9N3O2/c7-5-1-2-8-6(11)9(5)3-4-10/h1-2,10H,3-4,7H2
InChIKeyOQRNOMWHFLWGOO-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.18
Rot. Bonds2

About 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one

6-amino-1-(2-hydroxyethyl)pyrimidin-2-one (PubChem CID 56977468) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one.

Molecular Properties

Compound Name6-amino-1-(2-hydroxyethyl)pyrimidin-2-one
PubChem CID56977468
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name6-amino-1-(2-hydroxyethyl)pyrimidin-2-one
SMILESNc1ccnc(=O)n1CCO
InChIInChI=1S/C6H9N3O2/c7-5-1-2-8-6(11)9(5)3-4-10/h1-2,10H,3-4,7H2
InChIKeyOQRNOMWHFLWGOO-UHFFFAOYSA-N
XLogP-1.18
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one?
The IUPAC name of 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one (CID 56977468) is 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one.
What is the SMILES notation for 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one?
The canonical SMILES for 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one is Nc1ccnc(=O)n1CCO.
What is the InChIKey of 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one?
The InChIKey is OQRNOMWHFLWGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c7-5-1-2-8-6(11)9(5)3-4-10/h1-2,10H,3-4,7H2.
What are the key properties of 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one?
6-amino-1-(2-hydroxyethyl)pyrimidin-2-one has a molecular weight of 155.16 g/mol, XLogP of -1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(2-hydroxyethyl)pyrimidin-2-one is sourced from PubChem (CID 56977468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).