5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine

C13H14N2 — CID 144630318

IUPAC5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine
SMILESC=C/C=C(\C)c1cnn2ccc(C)cc12
InChIInChI=1S/C13H14N2/c1-4-5-11(3)12-9-14-15-7-6-10(2)8-13(12)15/h4-9H,1H2,2-3H3/b11-5+
InChIKeyWYWVFSKWLAAQBL-VZUCSPMQSA-N
MW198.27 g/mol
LogP3.23
Rot. Bonds2

About 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine

5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine (PubChem CID 144630318) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine
PubChem CID144630318
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine
SMILESC=C/C=C(\C)c1cnn2ccc(C)cc12
InChIInChI=1S/C13H14N2/c1-4-5-11(3)12-9-14-15-7-6-10(2)8-13(12)15/h4-9H,1H2,2-3H3/b11-5+
InChIKeyWYWVFSKWLAAQBL-VZUCSPMQSA-N
XLogP3.23
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

6-[cyclopropyl(formyl)amino]pyridine-3-carboxylic acid;ethane;5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine
CID 144630316
methyl 5-methylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 53399588
N'-hydroxy-5-methylpyrazolo[1,5-a]pyridine-3-carboximidamide
CID 83877423
2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
CID 112713205
2,4-dimethyl-1-[(2Z)-penta-2,4-dien-2-yl]benzene
CID 168947702
3-ethyl-5-methylpyrazolo[1,5-a]pyridine
CID 169164413
5-methyl-N-[2-(3-methylphenoxy)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 166192190
3-amino-3-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propanoic acid
CID 83836931
1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)ethylidenehydrazine
CID 91514959
2-methyl-2-[1-(5-methylpyrazolo[1,5-a]pyridine-3-carbonyl)piperidin-3-yl]propanoic acid
CID 154844231
ethyl 5-(hydroxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71464261
(2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-(5-methylpyrazolo[1,5-a]pyridin-3-yl)methanone
CID 154741465

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine?
The IUPAC name of 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine (CID 144630318) is 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine?
The canonical SMILES for 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine is C=C/C=C(\C)c1cnn2ccc(C)cc12.
What is the InChIKey of 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine?
The InChIKey is WYWVFSKWLAAQBL-VZUCSPMQSA-N. The full InChI is InChI=1S/C13H14N2/c1-4-5-11(3)12-9-14-15-7-6-10(2)8-13(12)15/h4-9H,1H2,2-3H3/b11-5+.
What are the key properties of 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine?
5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine has a molecular weight of 198.27 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(2E)-penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 144630318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).