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

C15H10N4O — CID 162660715

IUPAC1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
SMILESCc1cccc(C(=O)n2nc(C#N)c3cnccc32)c1
InChIInChI=1S/C15H10N4O/c1-10-3-2-4-11(7-10)15(20)19-14-5-6-17-9-12(14)13(8-16)18-19/h2-7,9H,1H3
InChIKeyJAFXAXMOEREGGD-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.30
Rot. Bonds1

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

1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile (PubChem CID 162660715) has the molecular formula C15H10N4O and a molecular weight of 262.27 g/mol. Its IUPAC name is 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile.

Molecular Properties

Compound Name1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
PubChem CID162660715
Molecular FormulaC15H10N4O
Molecular Weight262.27 g/mol
Exact Mass262.09
IUPAC Name1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile
SMILESCc1cccc(C(=O)n2nc(C#N)c3cnccc32)c1
InChIInChI=1S/C15H10N4O/c1-10-3-2-4-11(7-10)15(20)19-14-5-6-17-9-12(14)13(8-16)18-19/h2-7,9H,1H3
InChIKeyJAFXAXMOEREGGD-UHFFFAOYSA-N
XLogP2.30
TPSA71.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The IUPAC name of 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile (CID 162660715) is 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile.
What is the SMILES notation for 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The canonical SMILES for 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile is Cc1cccc(C(=O)n2nc(C#N)c3cnccc32)c1.
What is the InChIKey of 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
The InChIKey is JAFXAXMOEREGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O/c1-10-3-2-4-11(7-10)15(20)19-14-5-6-17-9-12(14)13(8-16)18-19/h2-7,9H,1H3.
What are the key properties of 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile?
1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile has a molecular weight of 262.27 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylbenzoyl)pyrazolo[4,3-c]pyridine-3-carbonitrile is sourced from PubChem (CID 162660715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).