N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine

C17H20N4 — CID 63772919

IUPACN-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine
SMILESCCNCc1cnc2c(c1)c(C)nn2-c1ccc(C)cc1
InChIInChI=1S/C17H20N4/c1-4-18-10-14-9-16-13(3)20-21(17(16)19-11-14)15-7-5-12(2)6-8-15/h5-9,11,18H,4,10H2,1-3H3
InChIKeyGLPHMZDZERPTAK-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.15
Rot. Bonds4

About N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine

N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine (PubChem CID 63772919) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine
PubChem CID63772919
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC NameN-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine
SMILESCCNCc1cnc2c(c1)c(C)nn2-c1ccc(C)cc1
InChIInChI=1S/C17H20N4/c1-4-18-10-14-9-16-13(3)20-21(17(16)19-11-14)15-7-5-12(2)6-8-15/h5-9,11,18H,4,10H2,1-3H3
InChIKeyGLPHMZDZERPTAK-UHFFFAOYSA-N
XLogP3.15
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methanamine
CID 63772920
N-[[3-methyl-1-(3-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine
CID 63771201
2-bromo-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]prop-2-en-1-amine
CID 115614760
3-methyl-1-(4-methylphenyl)-N-methylsulfonylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 146154538
4-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]phenol
CID 115603275
N-[[5-methyl-6-(3,4,5-trimethylpyrazol-1-yl)-3-pyridinyl]methyl]ethanamine
CID 80636117
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-N',N'-diethylethane-1,2-diamine
CID 60975578
N-[(3-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-5-yl)methyl]ethanamine
CID 63771712
N-[[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]methyl]ethanamine
CID 54982022
N-[(2,3-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]ethanamine
CID 104621807
1-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]cyclobutan-1-ol
CID 115621477
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-(1-methylpyrazol-3-yl)methanamine
CID 78921293

Frequently Asked Questions

What is the IUPAC name of N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine?
The IUPAC name of N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine (CID 63772919) is N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine.
What is the SMILES notation for N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine?
The canonical SMILES for N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine is CCNCc1cnc2c(c1)c(C)nn2-c1ccc(C)cc1.
What is the InChIKey of N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine?
The InChIKey is GLPHMZDZERPTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-4-18-10-14-9-16-13(3)20-21(17(16)19-11-14)15-7-5-12(2)6-8-15/h5-9,11,18H,4,10H2,1-3H3.
What are the key properties of N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine?
N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine has a molecular weight of 280.38 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-methyl-1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine is sourced from PubChem (CID 63772919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).