N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride

C10H16ClN5O2S — CID 119960337

IUPACN-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
SMILESCc1nn(C)c2ncc(S(=O)(=O)NCCN)cc12.Cl
InChIInChI=1S/C10H15N5O2S.ClH/c1-7-9-5-8(18(16,17)13-4-3-11)6-12-10(9)15(2)14-7;/h5-6,13H,3-4,11H2,1-2H3;1H
InChIKeyNIPXAFVWZZULHN-UHFFFAOYSA-N
MW305.79 g/mol
LogP-0.06
Rot. Bonds4

About N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride

N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride (PubChem CID 119960337) has the molecular formula C10H16ClN5O2S and a molecular weight of 305.79 g/mol. Its IUPAC name is N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
PubChem CID119960337
Molecular FormulaC10H16ClN5O2S
Molecular Weight305.79 g/mol
Exact Mass305.07
IUPAC NameN-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
SMILESCc1nn(C)c2ncc(S(=O)(=O)NCCN)cc12.Cl
InChIInChI=1S/C10H15N5O2S.ClH/c1-7-9-5-8(18(16,17)13-4-3-11)6-12-10(9)15(2)14-7;/h5-6,13H,3-4,11H2,1-2H3;1H
InChIKeyNIPXAFVWZZULHN-UHFFFAOYSA-N
XLogP-0.06
TPSA102.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.79
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide
CID 119960338
N-(1-amino-2-methylpropan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 86780661
N-(2-amino-2-phenylethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 119976302
1,3-dimethyl-N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 120721633
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide
CID 99606758
N-(2-aminoethyl)-1,3-dimethyl-N-(2-phenylethyl)pyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 120895643
1,3-dimethyl-N-piperidin-3-ylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 119964587
1,3-dimethyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethyl)pyrazolo[5,4-b]pyridine-5-sulfonamide
CID 75493835
1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide
CID 129341409
N-[(3R,4R)-1-ethyl-4-methylpyrrolidin-3-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide
CID 129490677
methyl (2R)-3-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)sulfonyl-methylamino]-2-methylpropanoate
CID 94811343
N-(2-aminoethyl)-1,3-dimethyl-N-(2-phenylethyl)pyrazolo[5,4-b]pyridine-5-sulfonamide
CID 120895644

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride (CID 119960337) is N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride is Cc1nn(C)c2ncc(S(=O)(=O)NCCN)cc12.Cl.
What is the InChIKey of N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride?
The InChIKey is NIPXAFVWZZULHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S.ClH/c1-7-9-5-8(18(16,17)13-4-3-11)6-12-10(9)15(2)14-7;/h5-6,13H,3-4,11H2,1-2H3;1H.
What are the key properties of N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride?
N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride has a molecular weight of 305.79 g/mol, XLogP of -0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride is sourced from PubChem (CID 119960337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).