N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide

C14H17N3O3S — CID 153156039

IUPACN-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(N2CCOCC2)c2cccnc12
InChIInChI=1S/C14H17N3O3S/c1-21(18,19)16-12-4-5-13(17-7-9-20-10-8-17)11-3-2-6-15-14(11)12/h2-6,16H,7-10H2,1H3
InChIKeyWBKKHTCJTNQUTG-UHFFFAOYSA-N
MW307.38 g/mol
LogP1.44
Rot. Bonds3

About N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide

N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide (PubChem CID 153156039) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide
PubChem CID153156039
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC NameN-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(N2CCOCC2)c2cccnc12
InChIInChI=1S/C14H17N3O3S/c1-21(18,19)16-12-4-5-13(17-7-9-20-10-8-17)11-3-2-6-15-14(11)12/h2-6,16H,7-10H2,1H3
InChIKeyWBKKHTCJTNQUTG-UHFFFAOYSA-N
XLogP1.44
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide?
The IUPAC name of N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide (CID 153156039) is N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide.
What is the SMILES notation for N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide?
The canonical SMILES for N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide is CS(=O)(=O)Nc1ccc(N2CCOCC2)c2cccnc12.
What is the InChIKey of N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide?
The InChIKey is WBKKHTCJTNQUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c1-21(18,19)16-12-4-5-13(17-7-9-20-10-8-17)11-3-2-6-15-14(11)12/h2-6,16H,7-10H2,1H3.
What are the key properties of N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide?
N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide has a molecular weight of 307.38 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-ylquinolin-8-yl)methanesulfonamide is sourced from PubChem (CID 153156039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).