6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide

C17H26N6O3S — CID 57402324

IUPAC6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C17H26N6O3S/c1-13-17(14(2)22(3)20-13)21-27(24,25)15-4-5-16(19-12-15)18-6-7-23-8-10-26-11-9-23/h4-5,12,21H,6-11H2,1-3H3,(H,18,19)
InChIKeyNJVJYTHCAZXYQQ-UHFFFAOYSA-N
MW394.50 g/mol
LogP0.98
Rot. Bonds7

About 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide

6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide (PubChem CID 57402324) has the molecular formula C17H26N6O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
PubChem CID57402324
Molecular FormulaC17H26N6O3S
Molecular Weight394.50 g/mol
Exact Mass394.18
IUPAC Name6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C17H26N6O3S/c1-13-17(14(2)22(3)20-13)21-27(24,25)15-4-5-16(19-12-15)18-6-7-23-8-10-26-11-9-23/h4-5,12,21H,6-11H2,1-3H3,(H,18,19)
InChIKeyNJVJYTHCAZXYQQ-UHFFFAOYSA-N
XLogP0.98
TPSA101.38 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

6-[(3,4-dichlorophenyl)methylamino]-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
CID 58561189
5-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 23551658
6-[2-(azepan-1-yl)ethylamino]-N-methylpyridine-3-sulfonamide
CID 133351391
N-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]benzenesulfonamide
CID 113025678
N-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]butane-1-sulfonamide
CID 113010893
5-(4-ethylphenyl)-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 143501437
5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 113340018
5-(methylideneamino)-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 145473021
methyl N-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]carbamate
CID 113010883
N-[2-[6-(2-morpholin-4-ylethylamino)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]benzenesulfonamide
CID 43957992
4-bromo-N-(1,3,5-trimethylpyrazol-4-yl)benzenesulfonamide
CID 3716725
N-butyl-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 5268046

Frequently Asked Questions

What is the IUPAC name of 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide (CID 57402324) is 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide is Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCN2CCOCC2)nc1.
What is the InChIKey of 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
The InChIKey is NJVJYTHCAZXYQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N6O3S/c1-13-17(14(2)22(3)20-13)21-27(24,25)15-4-5-16(19-12-15)18-6-7-23-8-10-26-11-9-23/h4-5,12,21H,6-11H2,1-3H3,(H,18,19).
What are the key properties of 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide?
6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide has a molecular weight of 394.50 g/mol, XLogP of 0.98, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-morpholin-4-ylethylamino)-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 57402324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).