1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine

C11H17N3 — CID 136756530

IUPAC1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine
SMILESCCn1ncc2c1NC(C)(C)C=C2C
InChIInChI=1S/C11H17N3/c1-5-14-10-9(7-12-14)8(2)6-11(3,4)13-10/h6-7,13H,5H2,1-4H3
InChIKeyXOIWVVSIICQEAZ-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.51
Rot. Bonds1

About 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine

1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine (PubChem CID 136756530) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine
PubChem CID136756530
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine
SMILESCCn1ncc2c1NC(C)(C)C=C2C
InChIInChI=1S/C11H17N3/c1-5-14-10-9(7-12-14)8(2)6-11(3,4)13-10/h6-7,13H,5H2,1-4H3
InChIKeyXOIWVVSIICQEAZ-UHFFFAOYSA-N
XLogP2.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethyl-2H,6H,7H-pyrazolo(3,4-b)pyridin-6-one
CID 135428373
4-methyl-1-(propan-2-yl)-1H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
CID 135600421
1,7-Dihydro-4-methyl-1-(2-methylpropyl)-6H-pyrazolo[3,4-b]pyridin-6-one
CID 135600423
1-(butan-2-yl)-4-methyl-1H,6H,7H-pyrazolo(3,4-b)pyridin-6-one
CID 135600424
1-cyclopentyl-4-methyl-1H,6H,7H-pyrazolo(3,4-b)pyridin-6-one
CID 135600425
1-cyclohexyl-4-methyl-7H-pyrazolo[5,4-b]pyridin-6-one
CID 135584534
1-[(1S)-1-cyclopropylethyl]-4-methyl-7H-pyrazolo[5,4-b]pyridin-6-one
CID 135903354
1,7-Dihydro-1,4-dimethyl-6H-pyrazolo[3,4-b]pyridin-6-one
CID 137219267
4-[(Z)-5-cyclohepta-1,3,6-trien-1-yl-1-iminopent-2-en-2-yl]-1-ethanimidoylpyrazol-5-amine
CID 123937238
1-(2,5-Dimethyl-3,6-dihydrobenzimidazol-5-yl)-4-ethenylpyrazol-5-amine
CID 134239844
1,3-Dimethyl-6,7-dihydropyrazolo[5,4-b]pyridine
CID 136948381
(3E,7E)-3,15-dimethyl-2,9,14,15-tetrazabicyclo[10.3.0]pentadeca-1(12),3,7,13-tetraene
CID 137200370

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine?
The IUPAC name of 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine (CID 136756530) is 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine.
What is the SMILES notation for 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine?
The canonical SMILES for 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine is CCn1ncc2c1NC(C)(C)C=C2C.
What is the InChIKey of 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine?
The InChIKey is XOIWVVSIICQEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-5-14-10-9(7-12-14)8(2)6-11(3,4)13-10/h6-7,13H,5H2,1-4H3.
What are the key properties of 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine?
1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine has a molecular weight of 191.28 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4,6,6-trimethyl-7H-pyrazolo[5,4-b]pyridine is sourced from PubChem (CID 136756530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).