N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide

C15H20N4O3S — CID 97346805

IUPACN-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
SMILESCOCCn1cc2c(n1)[C@H](NS(=O)(=O)c1cccnc1)CCC2
InChIInChI=1S/C15H20N4O3S/c1-22-9-8-19-11-12-4-2-6-14(15(12)17-19)18-23(20,21)13-5-3-7-16-10-13/h3,5,7,10-11,14,18H,2,4,6,8-9H2,1H3/t14-/m1/s1
InChIKeyRHPZOFFQDYSRLA-CQSZACIVSA-N
MW336.42 g/mol
LogP1.28
Rot. Bonds6

About N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide

N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide (PubChem CID 97346805) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
PubChem CID97346805
Molecular FormulaC15H20N4O3S
Molecular Weight336.42 g/mol
Exact Mass336.13
IUPAC NameN-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
SMILESCOCCn1cc2c(n1)[C@H](NS(=O)(=O)c1cccnc1)CCC2
InChIInChI=1S/C15H20N4O3S/c1-22-9-8-19-11-12-4-2-6-14(15(12)17-19)18-23(20,21)13-5-3-7-16-10-13/h3,5,7,10-11,14,18H,2,4,6,8-9H2,1H3/t14-/m1/s1
InChIKeyRHPZOFFQDYSRLA-CQSZACIVSA-N
XLogP1.28
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide with MolForge

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Related Compounds

N-[(7S)-2-(2,2,2-trifluoroethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
CID 97346822
N-(2-cyclopropylpyrimidin-4-yl)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-amine
CID 75475443
2-[(7S)-7-[(4-methoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-2-yl]-N,N-dimethylacetamide
CID 97346810
N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
CID 116650196
N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
CID 166242958
N-[(7S)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]-5-nitro-1,3-thiazol-2-amine
CID 124873796
1-(4-fluorophenyl)-N-[2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]-6-oxopyridazine-3-carboxamide
CID 139000931
1-[2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]-3-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)urea
CID 154787652
N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 131898317
N-(cyclobutylmethyl)pyridine-3-sulfonamide
CID 47331342
N-(2-methyl-3-oxo-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)pyridine-3-sulfonamide
CID 91910836
N-[2-(2-methoxyethylamino)ethyl]pyridine-3-sulfonamide
CID 83038911

Frequently Asked Questions

What is the IUPAC name of N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide (CID 97346805) is N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide is COCCn1cc2c(n1)[C@H](NS(=O)(=O)c1cccnc1)CCC2.
What is the InChIKey of N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide?
The InChIKey is RHPZOFFQDYSRLA-CQSZACIVSA-N. The full InChI is InChI=1S/C15H20N4O3S/c1-22-9-8-19-11-12-4-2-6-14(15(12)17-19)18-23(20,21)13-5-3-7-16-10-13/h3,5,7,10-11,14,18H,2,4,6,8-9H2,1H3/t14-/m1/s1.
What are the key properties of N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide?
N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide has a molecular weight of 336.42 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 97346805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).