5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine

C17H20N4O — CID 142608493

IUPAC5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine
SMILESCCOc1ncccc1-c1nc2c(C)nn(CC)c2cc1C
InChIInChI=1S/C17H20N4O/c1-5-21-14-10-11(3)15(19-16(14)12(4)20-21)13-8-7-9-18-17(13)22-6-2/h7-10H,5-6H2,1-4H3
InChIKeyVAZHDIZUYWHZFW-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.53
Rot. Bonds4

About 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine

5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine (PubChem CID 142608493) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine
PubChem CID142608493
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine
SMILESCCOc1ncccc1-c1nc2c(C)nn(CC)c2cc1C
InChIInChI=1S/C17H20N4O/c1-5-21-14-10-11(3)15(19-16(14)12(4)20-21)13-8-7-9-18-17(13)22-6-2/h7-10H,5-6H2,1-4H3
InChIKeyVAZHDIZUYWHZFW-UHFFFAOYSA-N
XLogP3.53
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

CS-526
CID 9833312
3-(1,2,5,6-Tetrahydro-4-pyridyl)-5-propoxypyrrolo(3,2-b)pyridine
CID 4029677
4-Methoxy-2-phenyl-2H-pyrazolo[4,3-c]quinoline
CID 11196622
2-[4-(1-Methyl-4-pyridin-4-yl-1H-pyrazol-3-yl)-phenoxymethyl]-quinoxaline
CID 11545641
3-[(2S)-2-amino-3-phenylpropoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647437
5-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 25072002
(NE)-N-[[5-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridin-3-yl]methylidene]hydroxylamine
CID 25093832
Jnj-42259152
CID 51353528
4-cyclohexyloxy-3-[(E)-2-(1-methylpyrazol-4-yl)ethenyl]-2H-pyrazolo[4,3-c]pyridine
CID 56943105
5-(1-methylpyrazol-4-yl)-3-[6-[(3R)-piperidin-3-yl]oxy-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 71253513
3-[(2S)-2-amino-3-(2,3-difluorophenyl)propoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 16731841
3-[(2S)-2-amino-3-phenylpropoxy]-5-{1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647436

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine?
The IUPAC name of 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine (CID 142608493) is 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine.
What is the SMILES notation for 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine?
The canonical SMILES for 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine is CCOc1ncccc1-c1nc2c(C)nn(CC)c2cc1C.
What is the InChIKey of 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine?
The InChIKey is VAZHDIZUYWHZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-5-21-14-10-11(3)15(19-16(14)12(4)20-21)13-8-7-9-18-17(13)22-6-2/h7-10H,5-6H2,1-4H3.
What are the key properties of 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine?
5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine has a molecular weight of 296.37 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxy-3-pyridinyl)-1-ethyl-3,6-dimethylpyrazolo[4,5-b]pyridine is sourced from PubChem (CID 142608493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).