6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride

C7H8ClN3O — CID 167733579

IUPAC6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride
SMILESCc1cc(=O)c2cn[nH]c2[nH]1.Cl
InChIInChI=1S/C7H7N3O.ClH/c1-4-2-6(11)5-3-8-10-7(5)9-4;/h2-3H,1H3,(H2,8,9,10,11);1H
InChIKeyPFULTONDRWPJFR-UHFFFAOYSA-N
MW185.61 g/mol
LogP0.98
Rot. Bonds

About 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride

6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride (PubChem CID 167733579) has the molecular formula C7H8ClN3O and a molecular weight of 185.61 g/mol. Its IUPAC name is 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride.

Molecular Properties

Compound Name6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride
PubChem CID167733579
Molecular FormulaC7H8ClN3O
Molecular Weight185.61 g/mol
Exact Mass185.04
IUPAC Name6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride
SMILESCc1cc(=O)c2cn[nH]c2[nH]1.Cl
InChIInChI=1S/C7H7N3O.ClH/c1-4-2-6(11)5-3-8-10-7(5)9-4;/h2-3H,1H3,(H2,8,9,10,11);1H
InChIKeyPFULTONDRWPJFR-UHFFFAOYSA-N
XLogP0.98
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,6-dimethyl-1H,4H,7H-pyrazolo(3,4-b)pyridin-4-one
CID 135426862
1H-pyrazolo[3,4-b]pyridin-4-ol
CID 135741602
6-(fluoromethyl)-1-methyl-7H-pyrazolo[5,4-b]pyridin-4-one
CID 156793360
6-Amino-1H-pyrazolo[3,4-b]pyridin-4(2H)-one
CID 135468205
6-(difluoromethyl)-1-methyl-7H-pyrazolo[5,4-b]pyridin-4-one
CID 137067856
6-(difluoromethyl)-2-methyl-7H-pyrazolo[3,4-b]pyridin-4-one
CID 172416548
6-methyl-1H,4H,7H-pyrazolo[3,4-b]pyridin-4-one, trifluoroacetic acid
CID 177801071
2,6-dimethyl-7H-pyrazolo[3,4-b]pyridin-4-one
CID 137195840
6-methyl-1H-pyrazolo[3,4-b]pyridin-4-ol
CID 136951526
1-ethyl-6-methyl-7H-pyrazolo[5,4-b]pyridin-4-one
CID 137030756
7,8-dihydro-1H-pyrazolo[5,4-b]azepin-4-one
CID 137156094
1,7-Dihydropyrazolo[5,4-b]pyridin-4-one;dihydrochloride
CID 137303534

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride?
The IUPAC name of 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride (CID 167733579) is 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride.
What is the SMILES notation for 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride?
The canonical SMILES for 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride is Cc1cc(=O)c2cn[nH]c2[nH]1.Cl.
What is the InChIKey of 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride?
The InChIKey is PFULTONDRWPJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O.ClH/c1-4-2-6(11)5-3-8-10-7(5)9-4;/h2-3H,1H3,(H2,8,9,10,11);1H.
What are the key properties of 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride?
6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride has a molecular weight of 185.61 g/mol, XLogP of 0.98, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,7-dihydropyrazolo[5,4-b]pyridin-4-one;hydrochloride is sourced from PubChem (CID 167733579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).