N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide

C24H28N2O4S — CID 2884920

IUPACN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide
SMILESCc1ccc(N(CC(O)CN2CCOCC2)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H28N2O4S/c1-19-6-9-22(10-7-19)26(18-23(27)17-25-12-14-30-15-13-25)31(28,29)24-11-8-20-4-2-3-5-21(20)16-24/h2-11,16,23,27H,12-15,17-18H2,1H3
InChIKeyIPFYZWASKJIRKT-UHFFFAOYSA-N
MW440.57 g/mol
LogP3.04
Rot. Bonds7

About N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide

N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide (PubChem CID 2884920) has the molecular formula C24H28N2O4S and a molecular weight of 440.57 g/mol. Its IUPAC name is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide
PubChem CID2884920
Molecular FormulaC24H28N2O4S
Molecular Weight440.57 g/mol
Exact Mass440.18
IUPAC NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide
SMILESCc1ccc(N(CC(O)CN2CCOCC2)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H28N2O4S/c1-19-6-9-22(10-7-19)26(18-23(27)17-25-12-14-30-15-13-25)31(28,29)24-11-8-20-4-2-3-5-21(20)16-24/h2-11,16,23,27H,12-15,17-18H2,1H3
InChIKeyIPFYZWASKJIRKT-UHFFFAOYSA-N
XLogP3.04
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.57
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Morpholine, 4-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]-
CID 658467
N-[4-(4-morpholinyl)phenyl]-2-naphthalenesulfonamide
CID 1921979
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]naphthalene-2-sulfonamide
CID 2472272
N-(2-Hydroxy-3-piperidin-1-yl-propyl)-4-methyl-N-p-tolyl-benzenesulfonamide
CID 2883960
N-(oxiran-2-ylmethyl)-N-phenylnaphthalene-2-sulfonamide
CID 3133058
N-[2-hydroxy-3-(piperidin-1-yl)propyl]-N-(4-methylphenyl)benzenesulfonamide
CID 3133128
N-(2-Hydroxy-3-piperidin-1-yl-propyl)-4-methyl-N-phenyl-benzenesulfonamide
CID 6603630
3,4-dimethyl-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 7938968
N-(2-(4-(dimethylamino)phenyl)-2-morpholinoethyl)naphthalene-2-sulfonamide
CID 16812485
N-benzyl-N-[[4-(diethylamino)phenyl]methyl]naphthalene-2-sulfonamide
CID 71623284
N-(2-hydroxy-3-morpholinopropyl)-N-phenylnaphthalene-2-sulfonamide hydrochloride
CID 6603009
N-(3-(diethylamino)-2-hydroxypropyl)-N-phenylnaphthalene-2-sulfonamide hydrochloride
CID 24747855

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide?
The IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide (CID 2884920) is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide is Cc1ccc(N(CC(O)CN2CCOCC2)S(=O)(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide?
The InChIKey is IPFYZWASKJIRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O4S/c1-19-6-9-22(10-7-19)26(18-23(27)17-25-12-14-30-15-13-25)31(28,29)24-11-8-20-4-2-3-5-21(20)16-24/h2-11,16,23,27H,12-15,17-18H2,1H3.
What are the key properties of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide?
N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-(4-methylphenyl)naphthalene-2-sulfonamide has a molecular weight of 440.57 g/mol, XLogP of 3.04, 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-(4-methylphenyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 2884920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).