4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine

C19H16N4O2 — CID 66927023

IUPAC4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine
SMILESCOc1ccc(Oc2ccc(-c3cncc4[nH]nc(N)c34)cc2)cc1
InChIInChI=1S/C19H16N4O2/c1-24-13-6-8-15(9-7-13)25-14-4-2-12(3-5-14)16-10-21-11-17-18(16)19(20)23-22-17/h2-11H,1H3,(H3,20,22,23)
InChIKeyNNQLBDBJOZUBKR-UHFFFAOYSA-N
MW332.36 g/mol
LogP4.01
Rot. Bonds4

About 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine

4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine (PubChem CID 66927023) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine.

Molecular Properties

Compound Name4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine
PubChem CID66927023
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC Name4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine
SMILESCOc1ccc(Oc2ccc(-c3cncc4[nH]nc(N)c34)cc2)cc1
InChIInChI=1S/C19H16N4O2/c1-24-13-6-8-15(9-7-13)25-14-4-2-12(3-5-14)16-10-21-11-17-18(16)19(20)23-22-17/h2-11H,1H3,(H3,20,22,23)
InChIKeyNNQLBDBJOZUBKR-UHFFFAOYSA-N
XLogP4.01
TPSA86.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine?
The IUPAC name of 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine (CID 66927023) is 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine.
What is the SMILES notation for 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine?
The canonical SMILES for 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine is COc1ccc(Oc2ccc(-c3cncc4[nH]nc(N)c34)cc2)cc1.
What is the InChIKey of 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine?
The InChIKey is NNQLBDBJOZUBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c1-24-13-6-8-15(9-7-13)25-14-4-2-12(3-5-14)16-10-21-11-17-18(16)19(20)23-22-17/h2-11H,1H3,(H3,20,22,23).
What are the key properties of 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine?
4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine has a molecular weight of 332.36 g/mol, XLogP of 4.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazolo[3,4-c]pyridin-3-amine is sourced from PubChem (CID 66927023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).