N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide

C14H13N5O2 — CID 163252006

IUPACN-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
SMILESCCOc1ncccc1-c1[nH]nc2nc(NC=O)ccc12
InChIInChI=1S/C14H13N5O2/c1-2-21-14-10(4-3-7-15-14)12-9-5-6-11(16-8-20)17-13(9)19-18-12/h3-8H,2H2,1H3,(H2,16,17,18,19,20)
InChIKeyODQJXDITDJQXLA-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.99
Rot. Bonds5

About N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide

N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide (PubChem CID 163252006) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide.

Molecular Properties

Compound NameN-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
PubChem CID163252006
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC NameN-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
SMILESCCOc1ncccc1-c1[nH]nc2nc(NC=O)ccc12
InChIInChI=1S/C14H13N5O2/c1-2-21-14-10(4-3-7-15-14)12-9-5-6-11(16-8-20)17-13(9)19-18-12/h3-8H,2H2,1H3,(H2,16,17,18,19,20)
InChIKeyODQJXDITDJQXLA-UHFFFAOYSA-N
XLogP1.99
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
CID 163251510
cyclopropane;N-[3-(4-cyclopropyloxy-2-methoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide
CID 163250887
3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine
CID 141182116
6-(2,4-difluorophenoxy)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine
CID 59834415
6-(2-ethoxy-3-pyridinyl)pyrazin-2-amine
CID 163312519
5-(2-ethoxy-3-pyridinyl)-3-methyl-1-propan-2-yl-2,3-dihydropyrazolo[4,3-b]pyridine-7-carbaldehyde
CID 163798812
3-(2-chlorophenyl)-2H-pyrazolo[3,4-b]pyridine
CID 91667303
3-chloro-6-(2-ethoxy-3-pyridinyl)pyridazine
CID 156502502
2-(2-ethoxy-3-pyridinyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 56707254
4-(2-ethoxy-3-pyridinyl)-3,5-dimethoxybenzoic acid
CID 122564734
[2-(1,3-benzothiazol-2-yl)phenyl] 2-ethoxypyridine-3-carboxylate
CID 7936346
2-fluoro-N-[3-(3-fluoro-2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]cyclopropane-1-carboxamide
CID 163251899

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The IUPAC name of N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide (CID 163252006) is N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide.
What is the SMILES notation for N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The canonical SMILES for N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide is CCOc1ncccc1-c1[nH]nc2nc(NC=O)ccc12.
What is the InChIKey of N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
The InChIKey is ODQJXDITDJQXLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c1-2-21-14-10(4-3-7-15-14)12-9-5-6-11(16-8-20)17-13(9)19-18-12/h3-8H,2H2,1H3,(H2,16,17,18,19,20).
What are the key properties of N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide?
N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide has a molecular weight of 283.29 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethoxy-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]formamide is sourced from PubChem (CID 163252006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).