2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one

C9H9N3O2 — CID 175776312

IUPAC2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCCOc1ncc2ccc(=O)[nH]c2n1
InChIInChI=1S/C9H9N3O2/c1-2-14-9-10-5-6-3-4-7(13)11-8(6)12-9/h3-5H,2H2,1H3,(H,10,11,12,13)
InChIKeyUUQRAFNYHYBBSH-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.72
Rot. Bonds2

About 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one

2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one (PubChem CID 175776312) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one
PubChem CID175776312
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCCOc1ncc2ccc(=O)[nH]c2n1
InChIInChI=1S/C9H9N3O2/c1-2-14-9-10-5-6-3-4-7(13)11-8(6)12-9/h3-5H,2H2,1H3,(H,10,11,12,13)
InChIKeyUUQRAFNYHYBBSH-UHFFFAOYSA-N
XLogP0.72
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(hydroxymethyl)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 142266200
2-heptyl-8H-pyrido[2,3-d]pyrimidin-7-one
CID 175827210
7-ethyl-1H-1,8-naphthyridin-2-one
CID 23335413
2-ethoxy-4H-[1,3]thiazolo[4,5-b]pyridin-5-one
CID 175731283
2-(2-hydroxyethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 121470912
2-(2,2-difluoroethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 118295998
2-ethoxybenzo[h]quinazoline
CID 141466495
7-ethoxy-1H-quinolin-2-one
CID 123474288
2-ethoxyquinazolin-6-ol
CID 162739873
2-(2-pyrrolidin-1-ylethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 121470891
2,4-diethyl-8H-pyrido[2,3-d]pyrimidin-7-one
CID 139618473
2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]sulfanyl]-1H-pyrimidin-6-one
CID 80893393

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one (CID 175776312) is 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one is CCOc1ncc2ccc(=O)[nH]c2n1.
What is the InChIKey of 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is UUQRAFNYHYBBSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-2-14-9-10-5-6-3-4-7(13)11-8(6)12-9/h3-5H,2H2,1H3,(H,10,11,12,13).
What are the key properties of 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one?
2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 191.19 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-8H-pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 175776312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).