(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide

C14H21N5O4S — CID 73292709

IUPAC(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide
SMILESCc1ccc(S(=O)(=O)N(CCN=[N+]=[N-])[C@@H](C(=O)NO)C(C)C)cc1
InChIInChI=1S/C14H21N5O4S/c1-10(2)13(14(20)17-21)19(9-8-16-18-15)24(22,23)12-6-4-11(3)5-7-12/h4-7,10,13,21H,8-9H2,1-3H3,(H,17,20)/t13-/m1/s1
InChIKeyZTOBNNQGIRZHDO-CYBMUJFWSA-N
MW355.42 g/mol
LogP1.83
Rot. Bonds8

About (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide

(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide (PubChem CID 73292709) has the molecular formula C14H21N5O4S and a molecular weight of 355.42 g/mol. Its IUPAC name is (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide.

Molecular Properties

Compound Name(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide
PubChem CID73292709
Molecular FormulaC14H21N5O4S
Molecular Weight355.42 g/mol
Exact Mass355.13
IUPAC Name(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide
SMILESCc1ccc(S(=O)(=O)N(CCN=[N+]=[N-])[C@@H](C(=O)NO)C(C)C)cc1
InChIInChI=1S/C14H21N5O4S/c1-10(2)13(14(20)17-21)19(9-8-16-18-15)24(22,23)12-6-4-11(3)5-7-12/h4-7,10,13,21H,8-9H2,1-3H3,(H,17,20)/t13-/m1/s1
InChIKeyZTOBNNQGIRZHDO-CYBMUJFWSA-N
XLogP1.83
TPSA135.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide 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

(2R)-2-[(4-fluoro-3-methylbenzene)sulfonamido]-N-hydroxy-3-methylbutanamide
CID 6539664
N-Hydroxy-N^2^-(3-Methylbutyl)-N^2^-(Naphthalen-2-Ylsulfonyl)-D-Valinamide
CID 53389286
(2R)-N-hydroxy-3-methyl-2-[(3-methylbenzene)sulfonamido]butanamide
CID 6539663
(2R)-2-[(4-fluoro-3-methylbenzene)sulfonamido]-4-(formamidomethanaminium)-N-hydroxybutanamide
CID 6539693
(2R)-2-[(4-fluoro-3-methylbenzene)sulfonamido]-4-[(1S)-1-formamidoethan-1-aminium]-N-hydroxybutanamide
CID 6539695
(2R)-2-[(4-fluoro-3-methylbenzene)sulfonamido]-4-(1-formamido-1-methylethan-1-aminium)-N-hydroxybutanamide
CID 6539697
2-[benzene(2-methylpropyl)sulfonamido]-N-hydroxyacetamide
CID 10613211
N-hydroxy-2-[(4-methylbenzene)(2-methylpropyl)sulfonamido]acetamide
CID 10732988
2-[(2-Methylpropyl)[[4-(trifluoromethyl)phenyl]sulfonyl]amino]acetohydroximic acid
CID 10808023
(S)-2-[(Biphenyl-4-sulfonyl)-isobutyl-amino]-N-hydroxy-4-methylsulfanyl-butyramide
CID 44291532
(2R)-N-hydroxy-1-[4-(2-phenylethynyl)phenyl]sulfonylpyrrolidine-2-carboxamide
CID 162677454
(2S)-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]-2-[(4-methylphenyl)sulfonylamino]butanamide
CID 10861539

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide?
The IUPAC name of (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide (CID 73292709) is (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide.
What is the SMILES notation for (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide?
The canonical SMILES for (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide is Cc1ccc(S(=O)(=O)N(CCN=[N+]=[N-])[C@@H](C(=O)NO)C(C)C)cc1.
What is the InChIKey of (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide?
The InChIKey is ZTOBNNQGIRZHDO-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H21N5O4S/c1-10(2)13(14(20)17-21)19(9-8-16-18-15)24(22,23)12-6-4-11(3)5-7-12/h4-7,10,13,21H,8-9H2,1-3H3,(H,17,20)/t13-/m1/s1.
What are the key properties of (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide?
(2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide has a molecular weight of 355.42 g/mol, XLogP of 1.83, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-azidoethyl-(4-methylphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide is sourced from PubChem (CID 73292709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).