N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide

C13H15N5O3 — CID 17198708

IUPACN-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide
SMILESCC(=O)Nn1ccc2nc(N3CCOCC3)ncc2c1=O
InChIInChI=1S/C13H15N5O3/c1-9(19)16-18-3-2-11-10(12(18)20)8-14-13(15-11)17-4-6-21-7-5-17/h2-3,8H,4-7H2,1H3,(H,16,19)
InChIKeyTWBIEBXEFQWTDR-UHFFFAOYSA-N
MW289.30 g/mol
LogP-0.28
Rot. Bonds2

About N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide

N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide (PubChem CID 17198708) has the molecular formula C13H15N5O3 and a molecular weight of 289.30 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide
PubChem CID17198708
Molecular FormulaC13H15N5O3
Molecular Weight289.30 g/mol
Exact Mass289.12
IUPAC NameN-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide
SMILESCC(=O)Nn1ccc2nc(N3CCOCC3)ncc2c1=O
InChIInChI=1S/C13H15N5O3/c1-9(19)16-18-3-2-11-10(12(18)20)8-14-13(15-11)17-4-6-21-7-5-17/h2-3,8H,4-7H2,1H3,(H,16,19)
InChIKeyTWBIEBXEFQWTDR-UHFFFAOYSA-N
XLogP-0.28
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide?
The IUPAC name of N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide (CID 17198708) is N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide.
What is the SMILES notation for N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide?
The canonical SMILES for N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide is CC(=O)Nn1ccc2nc(N3CCOCC3)ncc2c1=O.
What is the InChIKey of N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide?
The InChIKey is TWBIEBXEFQWTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O3/c1-9(19)16-18-3-2-11-10(12(18)20)8-14-13(15-11)17-4-6-21-7-5-17/h2-3,8H,4-7H2,1H3,(H,16,19).
What are the key properties of N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide?
N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide has a molecular weight of 289.30 g/mol, XLogP of -0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide is sourced from PubChem (CID 17198708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).