3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one

C13H18N4O3 — CID 103483632

IUPAC3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
SMILESO=C(Cn1cnc2c(c1=O)CCNC2)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c18-12(16-3-5-20-6-4-16)8-17-9-15-11-7-14-2-1-10(11)13(17)19/h9,14H,1-8H2
InChIKeyYYFHAVDMZXXPRQ-UHFFFAOYSA-N
MW278.31 g/mol
LogP-1.25
Rot. Bonds2

About 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one

3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one (PubChem CID 103483632) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
PubChem CID103483632
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Name3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
SMILESO=C(Cn1cnc2c(c1=O)CCNC2)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c18-12(16-3-5-20-6-4-16)8-17-9-15-11-7-14-2-1-10(11)13(17)19/h9,14H,1-8H2
InChIKeyYYFHAVDMZXXPRQ-UHFFFAOYSA-N
XLogP-1.25
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 5-1.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[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

7-(2-Methylpropanoyl)-2-morpholin-4-yl-3,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 136000256
3-[2-(2,2,2-Trifluoroethoxy)ethyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 103483902
7-(2-propoxypropanoyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
CID 136112902
5-ethyl-4-methyl-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-1H-pyrimidin-6-one
CID 136761454
2-Morpholin-4-yl-7-(2-piperidin-1-ylacetyl)-3,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 137058264
3-Chloro-4-morpholin-4-yl-4,5,6,7-tetrahydropyrido[3,4-d]pyrimidin-8-one
CID 87495589
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 135896979
2-morpholin-4-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
CID 136228139
3-(2-Methylpropanoyl)-2-morpholin-4-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 172729049
N-butan-2-yl-2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)acetamide
CID 103483475
N-tert-butyl-2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)acetamide
CID 103483477
3-(2-Oxo-2-piperidin-1-ylethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 103483484

Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one?
The IUPAC name of 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one (CID 103483632) is 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one.
What is the SMILES notation for 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one?
The canonical SMILES for 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one is O=C(Cn1cnc2c(c1=O)CCNC2)N1CCOCC1.
What is the InChIKey of 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one?
The InChIKey is YYFHAVDMZXXPRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c18-12(16-3-5-20-6-4-16)8-17-9-15-11-7-14-2-1-10(11)13(17)19/h9,14H,1-8H2.
What are the key properties of 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one?
3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one has a molecular weight of 278.31 g/mol, XLogP of -1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one is sourced from PubChem (CID 103483632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).