1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one

C10H11N3O — CID 83877089

IUPAC1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one
SMILESCC(=O)Cc1cnc2c(cnn2C)c1
InChIInChI=1S/C10H11N3O/c1-7(14)3-8-4-9-6-12-13(2)10(9)11-5-8/h4-6H,3H2,1-2H3
InChIKeyHIRQHRGFONOFNX-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.10
Rot. Bonds2

About 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one

1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one (PubChem CID 83877089) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one.

Molecular Properties

Compound Name1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one
PubChem CID83877089
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one
SMILESCC(=O)Cc1cnc2c(cnn2C)c1
InChIInChI=1S/C10H11N3O/c1-7(14)3-8-4-9-6-12-13(2)10(9)11-5-8/h4-6H,3H2,1-2H3
InChIKeyHIRQHRGFONOFNX-UHFFFAOYSA-N
XLogP1.10
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylpyrazolo[5,4-b]pyridin-5-yl)ethanamine
CID 19620145
methyl 3-methyl-4-[[(1-methylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]-1H-pyrrole-2-carboxylate
CID 166312640
1-(3-cyclopropyl-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-one
CID 83893618
5-benzyl-1-methyl-N-[(1-methylpyrazolo[5,4-b]pyridin-5-yl)methyl]pyrazole-4-carboxamide
CID 166341062
N-tert-butyl-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 166220665
N-(cyclopropylmethyl)-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 166220823
2-(1-methylpyrrolo[2,3-b]pyridin-5-yl)acetic acid
CID 118560478
1-methylpyrazolo[3,4-b]pyridine-5-sulfonyl chloride
CID 71757018
3-(3-methylphenyl)-3-[(1-methylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanoic acid
CID 166253825
2-(7-chloro-1-methylindazol-5-yl)acetic acid
CID 83891916
4-(1-methylpyrazolo[3,4-b]pyridin-5-yl)phenol
CID 139537130
(1R)-1-(1-methylpyrazolo[3,4-b]pyridin-5-yl)ethanamine
CID 165403100

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one?
The IUPAC name of 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one (CID 83877089) is 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one.
What is the SMILES notation for 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one?
The canonical SMILES for 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one is CC(=O)Cc1cnc2c(cnn2C)c1.
What is the InChIKey of 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one?
The InChIKey is HIRQHRGFONOFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7(14)3-8-4-9-6-12-13(2)10(9)11-5-8/h4-6H,3H2,1-2H3.
What are the key properties of 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one?
1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one has a molecular weight of 189.22 g/mol, XLogP of 1.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazolo[5,4-b]pyridin-5-yl)propan-2-one is sourced from PubChem (CID 83877089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).