1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine

C16H18N4 — CID 43725573

IUPAC1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1ccccc1CNc1cnc2c(c1)c(C)nn2C
InChIInChI=1S/C16H18N4/c1-11-6-4-5-7-13(11)9-17-14-8-15-12(2)19-20(3)16(15)18-10-14/h4-8,10,17H,9H2,1-3H3
InChIKeyTWYXXNLOMANDEJ-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.20
Rot. Bonds3

About 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine

1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine (PubChem CID 43725573) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine
PubChem CID43725573
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1ccccc1CNc1cnc2c(c1)c(C)nn2C
InChIInChI=1S/C16H18N4/c1-11-6-4-5-7-13(11)9-17-14-8-15-12(2)19-20(3)16(15)18-10-14/h4-8,10,17H,9H2,1-3H3
InChIKeyTWYXXNLOMANDEJ-UHFFFAOYSA-N
XLogP3.20
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)amino]methyl]benzene-1,2-diol
CID 61319914
N-[(2,3-difluorophenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 63668922
N-[(4-bromo-2-fluorophenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 43725626
1,3-dimethyl-N-(2-phenylethyl)pyrazolo[5,4-b]pyridin-5-amine
CID 43725592
1,3-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazolo[5,4-b]pyridin-5-amine
CID 62356069
1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine
CID 43725542
N-[(5-ethylfuran-2-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 62344911
1,3-dimethyl-N-(1,3-thiazol-5-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine
CID 62759821
N-[(5-chlorofuran-2-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 60780857
N-(1H-imidazol-5-ylmethyl)-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 62761757
N-[[3-(2-methoxyethoxy)phenyl]methyl]-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 75400539
1-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-3-[(2-ethoxyphenyl)methyl]urea
CID 146124549

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine?
The IUPAC name of 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine (CID 43725573) is 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine.
What is the SMILES notation for 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine?
The canonical SMILES for 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine is Cc1ccccc1CNc1cnc2c(c1)c(C)nn2C.
What is the InChIKey of 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine?
The InChIKey is TWYXXNLOMANDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11-6-4-5-7-13(11)9-17-14-8-15-12(2)19-20(3)16(15)18-10-14/h4-8,10,17H,9H2,1-3H3.
What are the key properties of 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine?
1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine has a molecular weight of 266.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-[(2-methylphenyl)methyl]pyrazolo[5,4-b]pyridin-5-amine is sourced from PubChem (CID 43725573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).