4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine

C17H18N8O — CID 178061700

IUPAC4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine
SMILESCOc1cc(Nc2cc(-c3nccc(C)n3)nn2C)nc2c1cnn2C
InChIInChI=1S/C17H18N8O/c1-10-5-6-18-16(20-10)12-7-15(24(2)23-12)21-14-8-13(26-4)11-9-19-25(3)17(11)22-14/h5-9H,1-4H3,(H,21,22)
InChIKeyQYRYNGIGXGICPO-UHFFFAOYSA-N
MW350.39 g/mol
LogP2.22
Rot. Bonds4

About 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine

4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine (PubChem CID 178061700) has the molecular formula C17H18N8O and a molecular weight of 350.39 g/mol. Its IUPAC name is 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine.

Molecular Properties

Compound Name4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine
PubChem CID178061700
Molecular FormulaC17H18N8O
Molecular Weight350.39 g/mol
Exact Mass350.16
IUPAC Name4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine
SMILESCOc1cc(Nc2cc(-c3nccc(C)n3)nn2C)nc2c1cnn2C
InChIInChI=1S/C17H18N8O/c1-10-5-6-18-16(20-10)12-7-15(24(2)23-12)21-14-8-13(26-4)11-9-19-25(3)17(11)22-14/h5-9H,1-4H3,(H,21,22)
InChIKeyQYRYNGIGXGICPO-UHFFFAOYSA-N
XLogP2.22
TPSA95.57 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.39
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

4-methoxy-1-methyl-N-[1-methyl-3-(6-methyl-2-pyridinyl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine
CID 178061656
N-[3-(3,5-dimethylphenyl)-1-methylpyrazol-5-yl]-4-methoxy-1-methylpyrazolo[5,4-b]pyridin-6-amine
CID 178061666
4-methoxy-1-methyl-N-[1-methyl-3-[6-(methylamino)-2-pyridinyl]pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine
CID 178061687
4-methoxy-N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-1-methylpyrazolo[5,4-b]pyridin-6-amine
CID 178061503
N-(4-methoxy-1-methylpyrazolo[5,4-b]pyridin-6-yl)-3-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 178061796
(5R)-5-[1-methyl-6-[(1-methyl-3-phenylpyrazol-5-yl)amino]pyrazolo[5,4-b]pyridin-4-yl]oxyoxan-3-ol
CID 178061560
(3S,4R)-3-[1-methyl-6-[(1-methyl-3-phenylpyrazol-5-yl)amino]pyrazolo[5,4-b]pyridin-4-yl]oxyoxan-4-ol
CID 178061654
1-methyl-N-(1-methyl-3-phenylpyrazol-5-yl)-4-[(2S)-oxolan-2-yl]pyrazolo[5,4-b]pyridin-6-amine
CID 178061816
4-N-cyclopentyl-1-methyl-6-N-[1-methyl-3-(1-methylpyrrolo[2,3-b]pyridin-6-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridine-4,6-diamine
CID 178061684
[(3R,4S)-3,4-dihydroxy-3-[[1-methyl-6-[[1-methyl-3-(3-methylphenyl)pyrazol-5-yl]amino]pyrazolo[5,4-b]pyridin-4-yl]amino]oxan-4-yl] hypoiodite
CID 178061842
1-methyl-4-N-[(3R)-3-methyloxolan-3-yl]-6-N-(1-methyl-3-phenylpyrazol-5-yl)pyrazolo[5,4-b]pyridine-4,6-diamine
CID 178061642
cis-(1S,2R)-2-[6-[[3-(3-methoxy-2-pyridinyl)-1,2-oxazol-5-yl]amino]-1-methylpyrazolo[5,4-b]pyridin-4-yl]oxycyclopentan-1-ol
CID 178061845

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine?
The IUPAC name of 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine (CID 178061700) is 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine.
What is the SMILES notation for 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine?
The canonical SMILES for 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine is COc1cc(Nc2cc(-c3nccc(C)n3)nn2C)nc2c1cnn2C.
What is the InChIKey of 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine?
The InChIKey is QYRYNGIGXGICPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N8O/c1-10-5-6-18-16(20-10)12-7-15(24(2)23-12)21-14-8-13(26-4)11-9-19-25(3)17(11)22-14/h5-9H,1-4H3,(H,21,22).
What are the key properties of 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine?
4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine has a molecular weight of 350.39 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-methyl-N-[1-methyl-3-(4-methylpyrimidin-2-yl)pyrazol-5-yl]pyrazolo[5,4-b]pyridin-6-amine is sourced from PubChem (CID 178061700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).