2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide

C20H23N5O2 — CID 67209555

IUPAC2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide
SMILESCc1cccnc1CNC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1
InChIInChI=1S/C20H23N5O2/c1-12-5-4-8-21-15(12)10-22-16(26)11-27-17-9-13(2)18-19(14-6-7-14)24-25(3)20(18)23-17/h4-5,8-9,14H,6-7,10-11H2,1-3H3,(H,22,26)
InChIKeyIDBDJWBHLHRUQC-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.55
Rot. Bonds6

About 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide

2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide (PubChem CID 67209555) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide
PubChem CID67209555
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide
SMILESCc1cccnc1CNC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1
InChIInChI=1S/C20H23N5O2/c1-12-5-4-8-21-15(12)10-22-16(26)11-27-17-9-13(2)18-19(14-6-7-14)24-25(3)20(18)23-17/h4-5,8-9,14H,6-7,10-11H2,1-3H3,(H,22,26)
InChIKeyIDBDJWBHLHRUQC-UHFFFAOYSA-N
XLogP2.55
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide (CID 67209555) is 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide is Cc1cccnc1CNC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1.
What is the InChIKey of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide?
The InChIKey is IDBDJWBHLHRUQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-12-5-4-8-21-15(12)10-22-16(26)11-27-17-9-13(2)18-19(14-6-7-14)24-25(3)20(18)23-17/h4-5,8-9,14H,6-7,10-11H2,1-3H3,(H,22,26).
What are the key properties of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide?
2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide has a molecular weight of 365.44 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(3-methyl-2-pyridinyl)methyl]acetamide is sourced from PubChem (CID 67209555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).