1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione

C11H11N3O2 — CID 67465628

IUPAC1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cnn2c1CCCC2
InChIInChI=1S/C11H11N3O2/c15-10-4-5-11(16)14(10)9-7-12-13-6-2-1-3-8(9)13/h4-5,7H,1-3,6H2
InChIKeyQSFIJTXZBCMLRK-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.65
Rot. Bonds1

About 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione

1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione (PubChem CID 67465628) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione
PubChem CID67465628
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cnn2c1CCCC2
InChIInChI=1S/C11H11N3O2/c15-10-4-5-11(16)14(10)9-7-12-13-6-2-1-3-8(9)13/h4-5,7H,1-3,6H2
InChIKeyQSFIJTXZBCMLRK-UHFFFAOYSA-N
XLogP0.65
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione 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

2-fluoro-1-(4-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)prop-2-en-1-one
CID 178674896
1-[5-(difluoromethyl)-1-methyl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-4-yl]-2-fluoroprop-2-en-1-one
CID 167982328
1-(4,6-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-fluoroprop-2-en-1-one
CID 176701626
1-(4,7-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-fluoroprop-2-en-1-one
CID 176703182
N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetamide
CID 58464816
1-(5-Methyl-4,5,6,7-tetrahydropyrazolo[4,5-b]pyridin-1-yl)ethanone
CID 89297108
1,4-dimethyl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine
CID 89591085
2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid
CID 90040560
Tert-butyl(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)carbamic acid
CID 118340740
1-methyl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine-4-carboxylic acid
CID 149719095
tert-butyl N-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)carbamate
CID 163590597
2-amino-1-(2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridin-4-yl)ethanone
CID 166081888

Frequently Asked Questions

What is the IUPAC name of 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione?
The IUPAC name of 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione (CID 67465628) is 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione?
The canonical SMILES for 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione is O=C1C=CC(=O)N1c1cnn2c1CCCC2.
What is the InChIKey of 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione?
The InChIKey is QSFIJTXZBCMLRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c15-10-4-5-11(16)14(10)9-7-12-13-6-2-1-3-8(9)13/h4-5,7H,1-3,6H2.
What are the key properties of 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione?
1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione has a molecular weight of 217.23 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione is sourced from PubChem (CID 67465628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).