N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide

C14H17N5O3S — CID 53185644

IUPACN-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide
SMILESCOc1nccnc1N1CCC(NS(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C14H17N5O3S/c1-22-14-13(16-6-7-17-14)19-8-4-11(10-19)18-23(20,21)12-3-2-5-15-9-12/h2-3,5-7,9,11,18H,4,8,10H2,1H3
InChIKeySNKCBQZKBSYATE-UHFFFAOYSA-N
MW335.39 g/mol
LogP0.44
Rot. Bonds5

About N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide

N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide (PubChem CID 53185644) has the molecular formula C14H17N5O3S and a molecular weight of 335.39 g/mol. Its IUPAC name is N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide
PubChem CID53185644
Molecular FormulaC14H17N5O3S
Molecular Weight335.39 g/mol
Exact Mass335.11
IUPAC NameN-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide
SMILESCOc1nccnc1N1CCC(NS(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C14H17N5O3S/c1-22-14-13(16-6-7-17-14)19-8-4-11(10-19)18-23(20,21)12-3-2-5-15-9-12/h2-3,5-7,9,11,18H,4,8,10H2,1H3
InChIKeySNKCBQZKBSYATE-UHFFFAOYSA-N
XLogP0.44
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide (CID 53185644) is N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide is COc1nccnc1N1CCC(NS(=O)(=O)c2cccnc2)C1.
What is the InChIKey of N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide?
The InChIKey is SNKCBQZKBSYATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O3S/c1-22-14-13(16-6-7-17-14)19-8-4-11(10-19)18-23(20,21)12-3-2-5-15-9-12/h2-3,5-7,9,11,18H,4,8,10H2,1H3.
What are the key properties of N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide?
N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide has a molecular weight of 335.39 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 53185644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).