5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one

C18H23N5O3 — CID 142103167

IUPAC5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
SMILESCCOc1ncc(C)cc1-c1nc2c(CC)n(CCOC)nc2c(=O)[nH]1
InChIInChI=1S/C18H23N5O3/c1-5-13-14-15(22-23(13)7-8-25-4)17(24)21-16(20-14)12-9-11(3)10-19-18(12)26-6-2/h9-10H,5-8H2,1-4H3,(H,20,21,24)
InChIKeyBQMWCULYPUEXOV-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.10
Rot. Bonds7

About 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one

5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one (PubChem CID 142103167) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
PubChem CID142103167
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
SMILESCCOc1ncc(C)cc1-c1nc2c(CC)n(CCOC)nc2c(=O)[nH]1
InChIInChI=1S/C18H23N5O3/c1-5-13-14-15(22-23(13)7-8-25-4)17(24)21-16(20-14)12-9-11(3)10-19-18(12)26-6-2/h9-10H,5-8H2,1-4H3,(H,20,21,24)
InChIKeyBQMWCULYPUEXOV-UHFFFAOYSA-N
XLogP2.10
TPSA94.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-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

5-[5-acetyl-2-(1-methoxypropan-2-yloxy)-3-pyridinyl]-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135455945
5-(5-amino-2-ethoxy-3-pyridinyl)-2-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135730637
5-(5-amino-2-ethoxy-3-pyridinyl)-3-[4-(2-methoxyethoxy)phenyl]-2-methyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135767299
5-(2-butoxy-5-ethynyl-3-pyridinyl)-3-ethyl-1-(2-methoxyethyl)-6H-pyrazolo[4,5-d]pyrimidin-7-one
CID 135730595
3-ethoxy-5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridinyl]-2-methyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135767311
2-cyclobutyl-5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridinyl]-3-ethyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135790106
5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridinyl]-3-ethyl-2-phenyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135469678
5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridinyl]-2-[(1-methylimidazol-2-yl)methyl]-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135810290
5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(1-ethylazetidin-3-yl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135515565
[5-[3-ethyl-7-oxo-2-(1-propan-2-ylazetidin-3-yl)-6H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxy-3-pyridinyl] acetate
CID 135438353
5-(5-acetyl-2-butoxy-3-pyridinyl)-3-ethyl-2-(1-ethylazetidin-3-yl)-6H-pyrazolo[4,3-d]pyrimidin-7-one;hydrochloride
CID 135673971
5-[5-ethynyl-2-(2-methylpropoxy)-3-pyridinyl]-2-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
CID 135730585

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one?
The IUPAC name of 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one (CID 142103167) is 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one.
What is the SMILES notation for 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one?
The canonical SMILES for 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one is CCOc1ncc(C)cc1-c1nc2c(CC)n(CCOC)nc2c(=O)[nH]1.
What is the InChIKey of 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one?
The InChIKey is BQMWCULYPUEXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-5-13-14-15(22-23(13)7-8-25-4)17(24)21-16(20-14)12-9-11(3)10-19-18(12)26-6-2/h9-10H,5-8H2,1-4H3,(H,20,21,24).
What are the key properties of 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one?
5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one has a molecular weight of 357.41 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxy-5-methyl-3-pyridinyl)-3-ethyl-2-(2-methoxyethyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one is sourced from PubChem (CID 142103167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).