3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine

C14H14N4 — CID 70626416

IUPAC3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine
SMILESCc1cc(-c2ccccc2)nc2nn(N)c(C)c12
InChIInChI=1S/C14H14N4/c1-9-8-12(11-6-4-3-5-7-11)16-14-13(9)10(2)18(15)17-14/h3-8H,15H2,1-2H3
InChIKeyNWLDIGTWSWUIFL-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.43
Rot. Bonds1

About 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine

3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine (PubChem CID 70626416) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine.

Molecular Properties

Compound Name3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine
PubChem CID70626416
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine
SMILESCc1cc(-c2ccccc2)nc2nn(N)c(C)c12
InChIInChI=1S/C14H14N4/c1-9-8-12(11-6-4-3-5-7-11)16-14-13(9)10(2)18(15)17-14/h3-8H,15H2,1-2H3
InChIKeyNWLDIGTWSWUIFL-UHFFFAOYSA-N
XLogP2.43
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine?
The IUPAC name of 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine (CID 70626416) is 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine.
What is the SMILES notation for 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine?
The canonical SMILES for 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine is Cc1cc(-c2ccccc2)nc2nn(N)c(C)c12.
What is the InChIKey of 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine?
The InChIKey is NWLDIGTWSWUIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-8-12(11-6-4-3-5-7-11)16-14-13(9)10(2)18(15)17-14/h3-8H,15H2,1-2H3.
What are the key properties of 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine?
3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine has a molecular weight of 238.29 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine is sourced from PubChem (CID 70626416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).