5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one

C9H14N4O3 — CID 136979788

IUPAC5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one
SMILESNc1c(N2CCOC(CO)C2)nc[nH]c1=O
InChIInChI=1S/C9H14N4O3/c10-7-8(11-5-12-9(7)15)13-1-2-16-6(3-13)4-14/h5-6,14H,1-4,10H2,(H,11,12,15)
InChIKeyOWBSGNSTFRJPAI-UHFFFAOYSA-N
MW226.24 g/mol
LogP-1.45
Rot. Bonds2

About 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one

5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one (PubChem CID 136979788) has the molecular formula C9H14N4O3 and a molecular weight of 226.24 g/mol. Its IUPAC name is 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one
PubChem CID136979788
Molecular FormulaC9H14N4O3
Molecular Weight226.24 g/mol
Exact Mass226.11
IUPAC Name5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one
SMILESNc1c(N2CCOC(CO)C2)nc[nH]c1=O
InChIInChI=1S/C9H14N4O3/c10-7-8(11-5-12-9(7)15)13-1-2-16-6(3-13)4-14/h5-6,14H,1-4,10H2,(H,11,12,15)
InChIKeyOWBSGNSTFRJPAI-UHFFFAOYSA-N
XLogP-1.45
TPSA104.47 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 5-1.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-9-[6-(hydroxymethyl)morpholin-2-yl]-7,8-dihydro-1H-purin-6-one
CID 167111296
4-[[(1R)-1-(1,3-dihydroxypropan-2-yloxy)-2-hydroxyethyl]-methylamino]-5-(methylideneamino)-1H-pyrimidin-6-one
CID 174310161
5-amino-4-(morpholin-2-ylmethoxy)-1H-pyrimidin-6-one
CID 114586612
5-amino-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 135786490
5-amino-4-(3,4-dihydroxypyrrolidin-1-yl)-1H-pyrimidin-6-one
CID 136766522
4-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
CID 136783253
4-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-5-iodo-1H-pyrimidin-6-one
CID 136783254
5-amino-4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
CID 136783272
5-amino-4-[(3S)-3-hydroxypiperidin-1-yl]-1H-pyrimidin-6-one
CID 136811790
5-amino-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1H-pyrimidin-6-one
CID 136825660
4-[2-(hydroxymethyl)morpholin-4-yl]-5-iodo-1H-pyrimidin-6-one
CID 136958037
5-bromo-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one
CID 136958039

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one (CID 136979788) is 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one is Nc1c(N2CCOC(CO)C2)nc[nH]c1=O.
What is the InChIKey of 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one?
The InChIKey is OWBSGNSTFRJPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O3/c10-7-8(11-5-12-9(7)15)13-1-2-16-6(3-13)4-14/h5-6,14H,1-4,10H2,(H,11,12,15).
What are the key properties of 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one?
5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one has a molecular weight of 226.24 g/mol, XLogP of -1.45, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[2-(hydroxymethyl)morpholin-4-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136979788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).