N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide

C19H24N2O4S — CID 3133092

IUPACN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(CC(O)CN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H24N2O4S/c22-18(15-20-11-13-25-14-12-20)16-21(17-7-3-1-4-8-17)26(23,24)19-9-5-2-6-10-19/h1-10,18,22H,11-16H2
InChIKeyPHULQHSCTJMMJL-UHFFFAOYSA-N
MW376.48 g/mol
LogP1.58
Rot. Bonds7

About N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide

N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide (PubChem CID 3133092) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide
PubChem CID3133092
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(CC(O)CN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H24N2O4S/c22-18(15-20-11-13-25-14-12-20)16-21(17-7-3-1-4-8-17)26(23,24)19-9-5-2-6-10-19/h1-10,18,22H,11-16H2
InChIKeyPHULQHSCTJMMJL-UHFFFAOYSA-N
XLogP1.58
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 1125478
N-[(2S)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-N-(4-methylphenyl)benzenesulfonamide
CID 1077008
N-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide
CID 1077012
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide
CID 3151264
N-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide
CID 1421082
N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylnaphthalene-2-sulfonamide
CID 3293139
N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-(4-nitrophenyl)benzenesulfonamide;hydrochloride
CID 52998314
N-[(2S)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 1077010
N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide
CID 90941820
N-(2-hydroxy-3-morpholin-4-ium-4-ylpropyl)-N-(4-methylphenyl)benzenesulfonamide
CID 4040881
N-(2-hydroxy-3-morpholin-4-ium-4-ylpropyl)-4-methyl-N-phenylbenzenesulfonamide
CID 3451825
N-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-4-methyl-N-phenylbenzenesulfonamide
CID 7429800

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide?
The IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide (CID 3133092) is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide.
What is the SMILES notation for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide?
The canonical SMILES for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide is O=S(=O)(c1ccccc1)N(CC(O)CN1CCOCC1)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide?
The InChIKey is PHULQHSCTJMMJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c22-18(15-20-11-13-25-14-12-20)16-21(17-7-3-1-4-8-17)26(23,24)19-9-5-2-6-10-19/h1-10,18,22H,11-16H2.
What are the key properties of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide?
N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide has a molecular weight of 376.48 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide is sourced from PubChem (CID 3133092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).