6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C26H30N8O2 — CID 156519337

IUPAC6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESC=N/C(=C\C=C(/C)c1cc(OCCOC)cn2ncc(C#N)c12)N1CCN(Cc2ncccn2)CC1
InChIInChI=1S/C26H30N8O2/c1-20(23-15-22(36-14-13-35-3)18-34-26(23)21(16-27)17-31-34)5-6-25(28-2)33-11-9-32(10-12-33)19-24-29-7-4-8-30-24/h4-8,15,17-18H,2,9-14,19H2,1,3H3/b20-5+,25-6+
InChIKeySUYBMNFDRDXROK-TYQNKIHMSA-N
MW486.58 g/mol
LogP2.78
Rot. Bonds10

About 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 156519337) has the molecular formula C26H30N8O2 and a molecular weight of 486.58 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID156519337
Molecular FormulaC26H30N8O2
Molecular Weight486.58 g/mol
Exact Mass486.25
IUPAC Name6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESC=N/C(=C\C=C(/C)c1cc(OCCOC)cn2ncc(C#N)c12)N1CCN(Cc2ncccn2)CC1
InChIInChI=1S/C26H30N8O2/c1-20(23-15-22(36-14-13-35-3)18-34-26(23)21(16-27)17-31-34)5-6-25(28-2)33-11-9-32(10-12-33)19-24-29-7-4-8-30-24/h4-8,15,17-18H,2,9-14,19H2,1,3H3/b20-5+,25-6+
InChIKeySUYBMNFDRDXROK-TYQNKIHMSA-N
XLogP2.78
TPSA104.17 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds10
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.58
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2-ethylbutoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyridin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 139313735
6-(2-methoxyethoxy)-4-[6-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436681
4-[(2E,4Z)-5-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-5-(methylideneamino)penta-2,4-dien-2-yl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 138601343
4-[(2E,4Z)-5-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]-5-(methylideneamino)penta-2,4-dien-2-yl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 126759894
4-[(2E,4Z)-5-(methylideneamino)-5-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]penta-2,4-dien-2-yl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 135178512
4-[(2E,4Z)-5-(methylideneamino)-5-[4-(morpholine-4-carbonyl)piperazin-1-yl]penta-2,4-dien-2-yl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 135177550
4-[6-[4-[(5-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]-6-(2-methoxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436741
N'-[(E)-2-(4-amino-4-methylpiperidin-1-yl)prop-1-enyl]-3-cyano-N-methylidene-6-(2-morpholin-4-ylethoxy)pyrazolo[1,5-a]pyridine-4-carboximidamide
CID 155455871
4-[6-(4-benzylpiperazin-1-yl)-3-pyridinyl]-6-[2-(trifluoromethoxy)ethoxy]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436794
6-(2-hydroxy-2-methylpropoxy)-4-[6-[methyl-[(2S,3E,5Z)-3-methyl-6-(methylideneamino)-6-pyrrolidin-1-ylhexa-3,5-dien-2-yl]amino]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 166807080
6-(2-methoxyethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134435407
6-(2,2-difluoroethoxy)-4-[6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436220

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 156519337) is 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile is C=N/C(=C\C=C(/C)c1cc(OCCOC)cn2ncc(C#N)c12)N1CCN(Cc2ncccn2)CC1.
What is the InChIKey of 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is SUYBMNFDRDXROK-TYQNKIHMSA-N. The full InChI is InChI=1S/C26H30N8O2/c1-20(23-15-22(36-14-13-35-3)18-34-26(23)21(16-27)17-31-34)5-6-25(28-2)33-11-9-32(10-12-33)19-24-29-7-4-8-30-24/h4-8,15,17-18H,2,9-14,19H2,1,3H3/b20-5+,25-6+.
What are the key properties of 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 486.58 g/mol, XLogP of 2.78, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-4-[(2E,4Z)-5-(methylideneamino)-5-[4-(pyrimidin-2-ylmethyl)piperazin-1-yl]penta-2,4-dien-2-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 156519337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).