N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide

C21H23N3O4S — CID 133347267

IUPACN-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCOC(c3ccco3)C2)nc1
InChIInChI=1S/C21H23N3O4S/c1-2-24(17-7-4-3-5-8-17)29(25,26)18-10-11-21(22-15-18)23-12-14-28-20(16-23)19-9-6-13-27-19/h3-11,13,15,20H,2,12,14,16H2,1H3
InChIKeyNHRBSQHZGPWFQB-UHFFFAOYSA-N
MW413.50 g/mol
LogP3.47
Rot. Bonds6

About N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide

N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide (PubChem CID 133347267) has the molecular formula C21H23N3O4S and a molecular weight of 413.50 g/mol. Its IUPAC name is N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide
PubChem CID133347267
Molecular FormulaC21H23N3O4S
Molecular Weight413.50 g/mol
Exact Mass413.14
IUPAC NameN-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCOC(c3ccco3)C2)nc1
InChIInChI=1S/C21H23N3O4S/c1-2-24(17-7-4-3-5-8-17)29(25,26)18-10-11-21(22-15-18)23-12-14-28-20(16-23)19-9-6-13-27-19/h3-11,13,15,20H,2,12,14,16H2,1H3
InChIKeyNHRBSQHZGPWFQB-UHFFFAOYSA-N
XLogP3.47
TPSA75.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.50
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide?
The IUPAC name of N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide (CID 133347267) is N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide.
What is the SMILES notation for N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide?
The canonical SMILES for N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide is CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCOC(c3ccco3)C2)nc1.
What is the InChIKey of N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide?
The InChIKey is NHRBSQHZGPWFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O4S/c1-2-24(17-7-4-3-5-8-17)29(25,26)18-10-11-21(22-15-18)23-12-14-28-20(16-23)19-9-6-13-27-19/h3-11,13,15,20H,2,12,14,16H2,1H3.
What are the key properties of N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide?
N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide has a molecular weight of 413.50 g/mol, XLogP of 3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[2-(furan-2-yl)morpholin-4-yl]-N-phenylpyridine-3-sulfonamide is sourced from PubChem (CID 133347267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).