N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide

C17H22N4O3S — CID 122283282

IUPACN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)N1CCOCC1
InChIInChI=1S/C17H22N4O3S/c22-25(23,21-9-11-24-12-10-21)19-15-6-2-1-5-14(15)16-13-20-8-4-3-7-17(20)18-16/h1-2,5-6,13,19H,3-4,7-12H2
InChIKeyXONRJRCHIIDAHZ-UHFFFAOYSA-N
MW362.46 g/mol
LogP1.88
Rot. Bonds4

About N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide

N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide (PubChem CID 122283282) has the molecular formula C17H22N4O3S and a molecular weight of 362.46 g/mol. Its IUPAC name is N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide
PubChem CID122283282
Molecular FormulaC17H22N4O3S
Molecular Weight362.46 g/mol
Exact Mass362.14
IUPAC NameN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)N1CCOCC1
InChIInChI=1S/C17H22N4O3S/c22-25(23,21-9-11-24-12-10-21)19-15-6-2-1-5-14(15)16-13-20-8-4-3-7-17(20)18-16/h1-2,5-6,13,19H,3-4,7-12H2
InChIKeyXONRJRCHIIDAHZ-UHFFFAOYSA-N
XLogP1.88
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide?
The IUPAC name of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide (CID 122283282) is N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide is O=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)N1CCOCC1.
What is the InChIKey of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide?
The InChIKey is XONRJRCHIIDAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3S/c22-25(23,21-9-11-24-12-10-21)19-15-6-2-1-5-14(15)16-13-20-8-4-3-7-17(20)18-16/h1-2,5-6,13,19H,3-4,7-12H2.
What are the key properties of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide?
N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide has a molecular weight of 362.46 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]morpholine-4-sulfonamide is sourced from PubChem (CID 122283282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).