cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide

C19H21N5O3 — CID 163250887

IUPACcyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
SMILESC1CC1.COc1nccc(OC2CC2)c1-c1[nH]nc2nc(NC=O)ccc12
InChIInChI=1S/C16H15N5O3.C3H6/c1-23-16-13(11(6-7-17-16)24-9-2-3-9)14-10-4-5-12(18-8-22)19-15(10)21-20-14;1-2-3-1/h4-9H,2-3H2,1H3,(H2,18,19,20,21,22);1-3H2
InChIKeyIUKUQFYIJGGREN-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.31
Rot. Bonds6

About cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide

cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide (PubChem CID 163250887) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide.

Molecular Properties

Compound Namecyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
PubChem CID163250887
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Namecyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
SMILESC1CC1.COc1nccc(OC2CC2)c1-c1[nH]nc2nc(NC=O)ccc12
InChIInChI=1S/C16H15N5O3.C3H6/c1-23-16-13(11(6-7-17-16)24-9-2-3-9)14-10-4-5-12(18-8-22)19-15(10)21-20-14;1-2-3-1/h4-9H,2-3H2,1H3,(H2,18,19,20,21,22);1-3H2
InChIKeyIUKUQFYIJGGREN-UHFFFAOYSA-N
XLogP3.31
TPSA102.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide 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 cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The IUPAC name of cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide (CID 163250887) is cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide.
What is the SMILES notation for cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The canonical SMILES for cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide is C1CC1.COc1nccc(OC2CC2)c1-c1[nH]nc2nc(NC=O)ccc12.
What is the InChIKey of cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The InChIKey is IUKUQFYIJGGREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3.C3H6/c1-23-16-13(11(6-7-17-16)24-9-2-3-9)14-10-4-5-12(18-8-22)19-15(10)21-20-14;1-2-3-1/h4-9H,2-3H2,1H3,(H2,18,19,20,21,22);1-3H2.
What are the key properties of cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide has a molecular weight of 367.41 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide is sourced from PubChem (CID 163250887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).