1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine

C14H22N6O2S — CID 155100110

IUPAC1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine
SMILESCn1ncc2c(N3CCC(CCNS(N)(=O)=O)CC3)ccnc21
InChIInChI=1S/C14H22N6O2S/c1-19-14-12(10-17-19)13(3-6-16-14)20-8-4-11(5-9-20)2-7-18-23(15,21)22/h3,6,10-11,18H,2,4-5,7-9H2,1H3,(H2,15,21,22)
InChIKeySXIOFOSWWBFEKI-UHFFFAOYSA-N
MW338.44 g/mol
LogP0.37
Rot. Bonds5

About 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine

1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine (PubChem CID 155100110) has the molecular formula C14H22N6O2S and a molecular weight of 338.44 g/mol. Its IUPAC name is 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine
PubChem CID155100110
Molecular FormulaC14H22N6O2S
Molecular Weight338.44 g/mol
Exact Mass338.15
IUPAC Name1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine
SMILESCn1ncc2c(N3CCC(CCNS(N)(=O)=O)CC3)ccnc21
InChIInChI=1S/C14H22N6O2S/c1-19-14-12(10-17-19)13(3-6-16-14)20-8-4-11(5-9-20)2-7-18-23(15,21)22/h3,6,10-11,18H,2,4-5,7-9H2,1H3,(H2,15,21,22)
InChIKeySXIOFOSWWBFEKI-UHFFFAOYSA-N
XLogP0.37
TPSA106.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.44
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

7-methoxy-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline
CID 54583395
1,3-dimethyl-2-oxo-5-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]-4H-pyrimido[4,5-d]pyrimidine;hydrochloride
CID 169003395
N-[2-[1-(6,7-dimethoxyquinolin-4-yl)piperidin-4-yl]ethyl]-2-oxopropane-1-sulfonamide
CID 162190437
[1-(8-methyl-7-oxo-1,8-naphthyridin-4-yl)piperidin-4-yl]methylsulfamoyl carbamate
CID 175581455
6,7-dimethyl-4-[4-[2-(sulfamoylamino)ethyl]azepan-1-yl]quinazoline
CID 159739862
4-phenyl-6-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrimidine
CID 134145904
5-[4-(aminomethyl)piperidin-1-yl]-1-methyl-1,8-naphthyridin-2-one
CID 164563721
3-methyl-2-oxo-5-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]-1,4-dihydropyrimido[4,5-d]pyrimidine;hydrochloride
CID 169003402
4-(2-fluorophenyl)-6-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrimidine
CID 134148683
4-[(3R)-3-(1,3-dioxolan-2-yl)piperidin-1-yl]-1-methylpyrazolo[3,4-b]pyridine
CID 124885077
3-cyano-6,7-dimethyl-4-[4-[2-(sulfamoylamino)ethyl]azepan-1-yl]quinoline
CID 157469584
2-[1-(3-bromo-4-pyridinyl)piperidin-4-yl]-N-methylethanamine
CID 113452072

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine?
The IUPAC name of 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine (CID 155100110) is 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine?
The canonical SMILES for 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine is Cn1ncc2c(N3CCC(CCNS(N)(=O)=O)CC3)ccnc21.
What is the InChIKey of 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine?
The InChIKey is SXIOFOSWWBFEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O2S/c1-19-14-12(10-17-19)13(3-6-16-14)20-8-4-11(5-9-20)2-7-18-23(15,21)22/h3,6,10-11,18H,2,4-5,7-9H2,1H3,(H2,15,21,22).
What are the key properties of 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine?
1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine has a molecular weight of 338.44 g/mol, XLogP of 0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 155100110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).