1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone

C15H21N5O — CID 95813797

IUPAC1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(Nc2n[nH]c3nc(C)cc(C)c23)CC1
InChIInChI=1S/C15H21N5O/c1-9-8-10(2)16-14-13(9)15(19-18-14)17-12-4-6-20(7-5-12)11(3)21/h8,12H,4-7H2,1-3H3,(H2,16,17,18,19)
InChIKeyZGNJWLAYYHIVCO-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.00
Rot. Bonds2

About 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone

1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone (PubChem CID 95813797) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone
PubChem CID95813797
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(Nc2n[nH]c3nc(C)cc(C)c23)CC1
InChIInChI=1S/C15H21N5O/c1-9-8-10(2)16-14-13(9)15(19-18-14)17-12-4-6-20(7-5-12)11(3)21/h8,12H,4-7H2,1-3H3,(H2,16,17,18,19)
InChIKeyZGNJWLAYYHIVCO-UHFFFAOYSA-N
XLogP2.00
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone with MolForge

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Related Compounds

cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone
CID 72900199
1-[4-[[3-[(3-amino-2-hydroxypropyl)amino]-5-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-yl]amino]piperidin-1-yl]ethanone
CID 166897992
1-[4-(4-methylanilino)piperidin-1-yl]ethanone
CID 5307205
1-[4-[[2-(dimethylamino)-6-methyl-3-pyridinyl]amino]piperidin-1-yl]ethanone
CID 75445155
2-(cyclobutylamino)-4,6-dimethylpyridine-3-carboxylic acid
CID 62414994
1-[4-[(5-methyl-1H-indol-7-yl)amino]piperidin-1-yl]ethanone
CID 141340761
N-(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 157017723
cyclopropyl-[4-[(4,6-dimethylpyrimidin-2-yl)amino]piperidin-1-yl]methanone
CID 47156722
10,12-dimethyl-N-(oxan-4-yl)-7-thia-3,4,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),4,9,11-pentaen-5-amine
CID 89445287
1-[4-[(2-anilino-5-methylpyrimidin-4-yl)amino]piperidin-1-yl]ethanone
CID 123184963
1-[4-(4-fluoro-3-methylanilino)piperidin-1-yl]ethanone
CID 62810559
1-[4-(3,5-difluoroanilino)piperidin-1-yl]ethanone
CID 43764958

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone (CID 95813797) is 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone is CC(=O)N1CCC(Nc2n[nH]c3nc(C)cc(C)c23)CC1.
What is the InChIKey of 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone?
The InChIKey is ZGNJWLAYYHIVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-9-8-10(2)16-14-13(9)15(19-18-14)17-12-4-6-20(7-5-12)11(3)21/h8,12H,4-7H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone?
1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone has a molecular weight of 287.37 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone is sourced from PubChem (CID 95813797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).