2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid

C14H19N3O2 — CID 79219769

IUPAC2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid
SMILESCCc1nc2c(c(C)nn2C)c(CC)c1CC(=O)O
InChIInChI=1S/C14H19N3O2/c1-5-9-10(7-12(18)19)11(6-2)15-14-13(9)8(3)16-17(14)4/h5-7H2,1-4H3,(H,18,19)
InChIKeyQAMQFNVPJVBJOZ-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.03
Rot. Bonds4

About 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid

2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid (PubChem CID 79219769) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid.

Molecular Properties

Compound Name2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid
PubChem CID79219769
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid
SMILESCCc1nc2c(c(C)nn2C)c(CC)c1CC(=O)O
InChIInChI=1S/C14H19N3O2/c1-5-9-10(7-12(18)19)11(6-2)15-14-13(9)8(3)16-17(14)4/h5-7H2,1-4H3,(H,18,19)
InChIKeyQAMQFNVPJVBJOZ-UHFFFAOYSA-N
XLogP2.03
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid?
The IUPAC name of 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid (CID 79219769) is 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid.
What is the SMILES notation for 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid?
The canonical SMILES for 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid is CCc1nc2c(c(C)nn2C)c(CC)c1CC(=O)O.
What is the InChIKey of 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid?
The InChIKey is QAMQFNVPJVBJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-5-9-10(7-12(18)19)11(6-2)15-14-13(9)8(3)16-17(14)4/h5-7H2,1-4H3,(H,18,19).
What are the key properties of 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid?
2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid has a molecular weight of 261.32 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-diethyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetic acid is sourced from PubChem (CID 79219769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).