N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide

C16H17N3O7S — CID 10810684

IUPACN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NO)Cc2ccccc2[N+](=O)[O-])cc1
InChIInChI=1S/C16H17N3O7S/c1-26-13-6-8-14(9-7-13)27(24,25)18(11-16(20)17-21)10-12-4-2-3-5-15(12)19(22)23/h2-9,21H,10-11H2,1H3,(H,17,20)
InChIKeyLEWMAZXEBPMBSY-UHFFFAOYSA-N
MW395.39 g/mol
LogP1.30
Rot. Bonds8

About N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide

N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide (PubChem CID 10810684) has the molecular formula C16H17N3O7S and a molecular weight of 395.39 g/mol. Its IUPAC name is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide
PubChem CID10810684
Molecular FormulaC16H17N3O7S
Molecular Weight395.39 g/mol
Exact Mass395.08
IUPAC NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NO)Cc2ccccc2[N+](=O)[O-])cc1
InChIInChI=1S/C16H17N3O7S/c1-26-13-6-8-14(9-7-13)27(24,25)18(11-16(20)17-21)10-12-4-2-3-5-15(12)19(22)23/h2-9,21H,10-11H2,1H3,(H,17,20)
InChIKeyLEWMAZXEBPMBSY-UHFFFAOYSA-N
XLogP1.30
TPSA139.08 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.39
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

(R)-2-(N-Benzyl-4-methoxyphenylsulfonamido)-N-hydroxy-3-methylbutanamide
CID 9821883
N-Hydroxy-2-[(4-methoxy-benzenesulfonyl)-(4-nitro-benzyl)-amino]-acetamide
CID 10500886
MMP-3 Inhibitor VIII
CID 10549329
N-hydroxy-2-[(4-methoxybenzene)(2-phenylethyl)sulfonamido]acetamide
CID 10570770
N-hydroxy-2-[[4-methoxybenzenesulfonyl](benzyl)amino]acetamide
CID 10594000
(2R)-2-[benzyl(4-methoxybenzene)sulfonamido]-N-hydroxypropanamide
CID 10594938
2-[benzyl(4-methoxybenzene)sulfonamido]-N-hydroxy-3,3-dimethylbutanamide
CID 10621353
(2R)-2-[benzyl(4-methoxybenzene)sulfonamido]-N-hydroxy-4,4-dimethylpentanamide
CID 10645799
N-hydroxy-2-[[4-methoxybenzenesulfonyl](4-methoxybenzyl)amino]acetamide
CID 10691191
N-hydroxy-2-[(4-methoxybenzene)[(3-methoxyphenyl)methyl]sulfonamido]acetamide
CID 10714796
(2R)-2-[benzyl(4-methoxybenzene)sulfonamido]-N-hydroxy-4-methylpentanamide
CID 10787514
2-[benzyl(4-methoxybenzene)sulfonamido]-N-hydroxy-3-methylbutanamide
CID 10834357

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide?
The IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide (CID 10810684) is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide.
What is the SMILES notation for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide?
The canonical SMILES for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide is COc1ccc(S(=O)(=O)N(CC(=O)NO)Cc2ccccc2[N+](=O)[O-])cc1.
What is the InChIKey of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide?
The InChIKey is LEWMAZXEBPMBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O7S/c1-26-13-6-8-14(9-7-13)27(24,25)18(11-16(20)17-21)10-12-4-2-3-5-15(12)19(22)23/h2-9,21H,10-11H2,1H3,(H,17,20).
What are the key properties of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide?
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide has a molecular weight of 395.39 g/mol, XLogP of 1.30, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[(2-nitrophenyl)methyl]amino]acetamide is sourced from PubChem (CID 10810684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).