N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide

C24H26N2O6S — CID 10183693

IUPACN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide
SMILESCc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCO3)cc2)c2ccccc2n1
InChIInChI=1S/C24H26N2O6S/c1-17-13-18(21-5-2-3-6-22(21)25-17)15-31-19-7-9-20(10-8-19)33(29,30)16-24(11-4-12-32-24)14-23(27)26-28/h2-3,5-10,13,28H,4,11-12,14-16H2,1H3,(H,26,27)
InChIKeyLCIIHDPWZSSNGB-UHFFFAOYSA-N
MW470.55 g/mol
LogP3.34
Rot. Bonds8

About N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide

N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide (PubChem CID 10183693) has the molecular formula C24H26N2O6S and a molecular weight of 470.55 g/mol. Its IUPAC name is N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide
PubChem CID10183693
Molecular FormulaC24H26N2O6S
Molecular Weight470.55 g/mol
Exact Mass470.15
IUPAC NameN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide
SMILESCc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCO3)cc2)c2ccccc2n1
InChIInChI=1S/C24H26N2O6S/c1-17-13-18(21-5-2-3-6-22(21)25-17)15-31-19-7-9-20(10-8-19)33(29,30)16-24(11-4-12-32-24)14-23(27)26-28/h2-3,5-10,13,28H,4,11-12,14-16H2,1H3,(H,26,27)
InChIKeyLCIIHDPWZSSNGB-UHFFFAOYSA-N
XLogP3.34
TPSA114.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.55
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide?
The IUPAC name of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide (CID 10183693) is N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide.
What is the SMILES notation for N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide?
The canonical SMILES for N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide is Cc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCO3)cc2)c2ccccc2n1.
What is the InChIKey of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide?
The InChIKey is LCIIHDPWZSSNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O6S/c1-17-13-18(21-5-2-3-6-22(21)25-17)15-31-19-7-9-20(10-8-19)33(29,30)16-24(11-4-12-32-24)14-23(27)26-28/h2-3,5-10,13,28H,4,11-12,14-16H2,1H3,(H,26,27).
What are the key properties of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide?
N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide has a molecular weight of 470.55 g/mol, XLogP of 3.34, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]oxolan-2-yl]acetamide is sourced from PubChem (CID 10183693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).