2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one

C13H20N4O2 — CID 136941292

IUPAC2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one
SMILESCCCN1CCOC(c2nc3c(c(=O)[nH]2)CNC3)C1
InChIInChI=1S/C13H20N4O2/c1-2-3-17-4-5-19-11(8-17)12-15-10-7-14-6-9(10)13(18)16-12/h11,14H,2-8H2,1H3,(H,15,16,18)
InChIKeyHIUCKFWBZWDJJS-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.16
Rot. Bonds3

About 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one

2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one (PubChem CID 136941292) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one
PubChem CID136941292
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one
SMILESCCCN1CCOC(c2nc3c(c(=O)[nH]2)CNC3)C1
InChIInChI=1S/C13H20N4O2/c1-2-3-17-4-5-19-11(8-17)12-15-10-7-14-6-9(10)13(18)16-12/h11,14H,2-8H2,1H3,(H,15,16,18)
InChIKeyHIUCKFWBZWDJJS-UHFFFAOYSA-N
XLogP0.16
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-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-(4-ethylmorpholin-2-yl)-5-fluoro-4-methyl-1H-pyrimidin-6-one
CID 136295876
5-fluoro-4-methyl-2-(4-propylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 136295906
2,3-dimethyl-6-(3-morpholinylacetyl)-3,5,6,7-tetrahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one
CID 56910816
2,3-dimethyl-6-[2-[(3R)-morpholin-3-yl]acetyl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-one
CID 95725994
2,3-dimethyl-6-[2-[(3S)-morpholin-3-yl]acetyl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-one
CID 95725995
5-(aminomethyl)-2-(4-propan-2-ylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 104189963
5-(aminomethyl)-2-(4-methylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 104190010
5-(aminomethyl)-2-(4-ethylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 113385101
5-(aminomethyl)-2-(4-propylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 113385102
5-(methylaminomethyl)-2-(4-methylmorpholin-2-yl)-1H-pyrimidin-6-one
CID 114206196
6-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2,3-dimethyl-3,5,6,7-tetrahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one
CID 118783433
4-methyl-5-(morpholine-4-carbonyl)-2-propan-2-yl-1H-pyrimidin-6-one
CID 136062315

Frequently Asked Questions

What is the IUPAC name of 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one?
The IUPAC name of 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one (CID 136941292) is 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one.
What is the SMILES notation for 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one?
The canonical SMILES for 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one is CCCN1CCOC(c2nc3c(c(=O)[nH]2)CNC3)C1.
What is the InChIKey of 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one?
The InChIKey is HIUCKFWBZWDJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-3-17-4-5-19-11(8-17)12-15-10-7-14-6-9(10)13(18)16-12/h11,14H,2-8H2,1H3,(H,15,16,18).
What are the key properties of 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one?
2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one has a molecular weight of 264.33 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propylmorpholin-2-yl)-3,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidin-4-one is sourced from PubChem (CID 136941292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).