2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one

C11H14N4O — CID 123379391

IUPAC2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
SMILESCCn1c(=O)c(C)cc2c(C)nc(N)nc21
InChIInChI=1S/C11H14N4O/c1-4-15-9-8(5-6(2)10(15)16)7(3)13-11(12)14-9/h5H,4H2,1-3H3,(H2,12,13,14)
InChIKeyUHTQZACEMXXNQW-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.01
Rot. Bonds1

About 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one

2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one (PubChem CID 123379391) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
PubChem CID123379391
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
SMILESCCn1c(=O)c(C)cc2c(C)nc(N)nc21
InChIInChI=1S/C11H14N4O/c1-4-15-9-8(5-6(2)10(15)16)7(3)13-11(12)14-9/h5H,4H2,1-3H3,(H2,12,13,14)
InChIKeyUHTQZACEMXXNQW-UHFFFAOYSA-N
XLogP1.01
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-bromo-8-ethyl-2-(ethylamino)-4-methylpyrido[2,3-d]pyrimidin-7(8H)-one
CID 886207
2-amino-4-methyl-6-(2-oxo-1H-pyrimidin-5-yl)-8-propan-2-ylpyrido[2,3-d]pyrimidin-7-one
CID 59258868
2-Amino-6-bromo-8-(2-hydroxy-2-methylpropyl)-4-methylpyrido[2,3-d]pyrimidin-7-one
CID 59258869
2-amino-6-bromo-4-methyl-8-(tetrahydrofuran-3-yl)pyrido[2,3-d]pyrimidin-7(8H)-one
CID 59258940
2-Amino-6-bromo-4-methyl-8-(4-oxocyclohexyl)pyrido[2,3-d]pyrimidin-7-one
CID 59258999
2-Amino-6-bromo-4-methyl-8-(oxolan-3-ylmethyl)pyrido[2,3-d]pyrimidin-7-one
CID 59259006
3-[8-Cyclopentyl-2-(ethylamino)-4-methyl-7-oxopyrido[2,3-d]pyrimidin-6-yl]propanamide
CID 59258902
4-amino-2,7-dimethyl-6H-pyrido[4,3-d]pyrimidin-5-one
CID 56664931
2,4-diamino-7-methyl-6H-pyrido[4,3-d]pyrimidin-5-one
CID 56681908
6-(2-{[2-(Dimethylamino)-5,6-dimethylpyrimidin-4-YL]amino}ethyl)-2-methylpyrimidin-4-OL
CID 136069341
2,4-dimethyl-8H-pyrido[2,3-d]pyrimidin-7-one
CID 12795380
8-Ethyl-2-(ethylamino)-6-(4-ethyl-2-fluorocyclohexa-1,5-dien-1-yl)-4-methylpyrido[2,3-d]pyrimidin-7-one
CID 123436499

Frequently Asked Questions

What is the IUPAC name of 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one (CID 123379391) is 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one is CCn1c(=O)c(C)cc2c(C)nc(N)nc21.
What is the InChIKey of 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The InChIKey is UHTQZACEMXXNQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-4-15-9-8(5-6(2)10(15)16)7(3)13-11(12)14-9/h5H,4H2,1-3H3,(H2,12,13,14).
What are the key properties of 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one has a molecular weight of 218.26 g/mol, XLogP of 1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-8-ethyl-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 123379391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).