1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one

C11H15N3O — CID 135686633

IUPAC1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCCCc1cc(=O)[nH]c2c1c(C)nn2C
InChIInChI=1S/C11H15N3O/c1-4-5-8-6-9(15)12-11-10(8)7(2)13-14(11)3/h6H,4-5H2,1-3H3,(H,12,15)
InChIKeyBCKGPFXAGQRZAA-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.52
Rot. Bonds2

About 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one

1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 135686633) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID135686633
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCCCc1cc(=O)[nH]c2c1c(C)nn2C
InChIInChI=1S/C11H15N3O/c1-4-5-8-6-9(15)12-11-10(8)7(2)13-14(11)3/h6H,4-5H2,1-3H3,(H,12,15)
InChIKeyBCKGPFXAGQRZAA-UHFFFAOYSA-N
XLogP1.52
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one (CID 135686633) is 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one is CCCc1cc(=O)[nH]c2c1c(C)nn2C.
What is the InChIKey of 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is BCKGPFXAGQRZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-4-5-8-6-9(15)12-11-10(8)7(2)13-14(11)3/h6H,4-5H2,1-3H3,(H,12,15).
What are the key properties of 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one?
1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 205.26 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-propyl-7H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 135686633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).