1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile

C11H8N4O — CID 162653838

IUPAC1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
SMILESN#Cc1nn(C(=O)C2CC2)c2ccncc12
InChIInChI=1S/C11H8N4O/c12-5-9-8-6-13-4-3-10(8)15(14-9)11(16)7-1-2-7/h3-4,6-7H,1-2H2
InChIKeyDHYXAKZNFKQCOW-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.35
Rot. Bonds1

About 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile

1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile (PubChem CID 162653838) has the molecular formula C11H8N4O and a molecular weight of 212.21 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
PubChem CID162653838
Molecular FormulaC11H8N4O
Molecular Weight212.21 g/mol
Exact Mass212.07
IUPAC Name1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
SMILESN#Cc1nn(C(=O)C2CC2)c2ccncc12
InChIInChI=1S/C11H8N4O/c12-5-9-8-6-13-4-3-10(8)15(14-9)11(16)7-1-2-7/h3-4,6-7H,1-2H2
InChIKeyDHYXAKZNFKQCOW-UHFFFAOYSA-N
XLogP1.35
TPSA71.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The IUPAC name of 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile (CID 162653838) is 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile.
What is the SMILES notation for 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The canonical SMILES for 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile is N#Cc1nn(C(=O)C2CC2)c2ccncc12.
What is the InChIKey of 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The InChIKey is DHYXAKZNFKQCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O/c12-5-9-8-6-13-4-3-10(8)15(14-9)11(16)7-1-2-7/h3-4,6-7H,1-2H2.
What are the key properties of 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile has a molecular weight of 212.21 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)pyrazolo[4,3-c]pyridine-3-carbonitrile is sourced from PubChem (CID 162653838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).