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

C25H29N3O5S — CID 10299665

IUPACN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide
SMILESCc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCCN3)cc2)c2ccccc2n1
InChIInChI=1S/C25H29N3O5S/c1-18-14-19(22-6-2-3-7-23(22)27-18)16-33-20-8-10-21(11-9-20)34(31,32)17-25(15-24(29)28-30)12-4-5-13-26-25/h2-3,6-11,14,26,30H,4-5,12-13,15-17H2,1H3,(H,28,29)
InChIKeyMBVFAXQWLSRZPW-UHFFFAOYSA-N
MW483.59 g/mol
LogP3.30
Rot. Bonds8

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

N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide (PubChem CID 10299665) has the molecular formula C25H29N3O5S and a molecular weight of 483.59 g/mol. Its IUPAC name is N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide
PubChem CID10299665
Molecular FormulaC25H29N3O5S
Molecular Weight483.59 g/mol
Exact Mass483.18
IUPAC NameN-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide
SMILESCc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCCN3)cc2)c2ccccc2n1
InChIInChI=1S/C25H29N3O5S/c1-18-14-19(22-6-2-3-7-23(22)27-18)16-33-20-8-10-21(11-9-20)34(31,32)17-25(15-24(29)28-30)12-4-5-13-26-25/h2-3,6-11,14,26,30H,4-5,12-13,15-17H2,1H3,(H,28,29)
InChIKeyMBVFAXQWLSRZPW-UHFFFAOYSA-N
XLogP3.30
TPSA117.62 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.59
LogP ≤ 53.30
H-Bond Donors ≤ 53
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'}

Analyze N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide?
The IUPAC name of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide (CID 10299665) is N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide.
What is the SMILES notation for N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide?
The canonical SMILES for N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide is Cc1cc(COc2ccc(S(=O)(=O)CC3(CC(=O)NO)CCCCN3)cc2)c2ccccc2n1.
What is the InChIKey of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide?
The InChIKey is MBVFAXQWLSRZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O5S/c1-18-14-19(22-6-2-3-7-23(22)27-18)16-33-20-8-10-21(11-9-20)34(31,32)17-25(15-24(29)28-30)12-4-5-13-26-25/h2-3,6-11,14,26,30H,4-5,12-13,15-17H2,1H3,(H,28,29).
What are the key properties of N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide?
N-hydroxy-2-[2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylmethyl]piperidin-2-yl]acetamide has a molecular weight of 483.59 g/mol, XLogP of 3.30, 8 rotatable bonds, 3 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]piperidin-2-yl]acetamide is sourced from PubChem (CID 10299665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).