5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione

C7H11N3O3 — CID 7373407

IUPAC5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione
SMILESCN(CCO)c1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H11N3O3/c1-10(2-3-11)5-4-8-7(13)9-6(5)12/h4,11H,2-3H2,1H3,(H2,8,9,12,13)
InChIKeyGPZJYRFPZUZBFK-UHFFFAOYSA-N
MW185.18 g/mol
LogP-1.51
Rot. Bonds3

About 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione

5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione (PubChem CID 7373407) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione
PubChem CID7373407
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Name5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione
SMILESCN(CCO)c1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H11N3O3/c1-10(2-3-11)5-4-8-7(13)9-6(5)12/h4,11H,2-3H2,1H3,(H2,8,9,12,13)
InChIKeyGPZJYRFPZUZBFK-UHFFFAOYSA-N
XLogP-1.51
TPSA89.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione (CID 7373407) is 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione is CN(CCO)c1c[nH]c(=O)[nH]c1=O.
What is the InChIKey of 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione?
The InChIKey is GPZJYRFPZUZBFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c1-10(2-3-11)5-4-8-7(13)9-6(5)12/h4,11H,2-3H2,1H3,(H2,8,9,12,13).
What are the key properties of 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione?
5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione has a molecular weight of 185.18 g/mol, XLogP of -1.51, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-hydroxyethyl(methyl)amino]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 7373407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).