N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide

C18H17N3O2S — CID 87444238

IUPACN-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide
SMILESO=C(NO)C(c1ccccc1)c1cccc(NCc2nccs2)c1
InChIInChI=1S/C18H17N3O2S/c22-18(21-23)17(13-5-2-1-3-6-13)14-7-4-8-15(11-14)20-12-16-19-9-10-24-16/h1-11,17,20,23H,12H2,(H,21,22)
InChIKeyWQTUXMXQLFFNDC-UHFFFAOYSA-N
MW339.42 g/mol
LogP3.39
Rot. Bonds6

About N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide

N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide (PubChem CID 87444238) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide
PubChem CID87444238
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC NameN-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide
SMILESO=C(NO)C(c1ccccc1)c1cccc(NCc2nccs2)c1
InChIInChI=1S/C18H17N3O2S/c22-18(21-23)17(13-5-2-1-3-6-13)14-7-4-8-15(11-14)20-12-16-19-9-10-24-16/h1-11,17,20,23H,12H2,(H,21,22)
InChIKeyWQTUXMXQLFFNDC-UHFFFAOYSA-N
XLogP3.39
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 53.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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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Related Compounds

5-[(3,5-dimethylbenzoyl)amino]-2-methyl-N-(2-methyl-1,3-thiazol-5-yl)benzamide
CID 23629682
(2S)-3-phenyl-N-(3-phenylphenyl)-2-(1,3-thiazol-4-ylmethylamino)propanamide
CID 69641748
(2S)-8-oxo-N-(3-phenylphenyl)-2-(1,3-thiazol-5-ylamino)nonanamide
CID 44456968
trans-(1R,2R)-N-[(2S,3S)-2-amino-3-methylpentyl]-N-(4-phenylphenyl)-2-(1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 118727639
N-(3-methylphenyl)-3-[1-(1,3-thiazol-2-ylmethyl)piperidin-4-yl]propanamide
CID 24817466
N-phenyl-3-[1-(1,3-thiazol-2-ylmethyl)piperidin-4-yl]propanamide
CID 42460383
3-(2-methylpropanoylamino)-N-[1-[3-(1,3-thiazol-2-yl)phenyl]ethyl]benzamide
CID 141730975
N-[3-[(4-oxo-5,6,7,8-tetrahydro-1H-phthalazin-1-yl)methyl]phenyl]-1,3-thiazole-2-carboxamide
CID 124221025
N,N-diethyl-4-[piperazin-1-yl-[3-(1,3-thiazol-2-ylmethylamino)phenyl]methyl]benzamide
CID 11619615
N-(3'-fluoro-4-biphenylyl)-1-(1,3-thiazol-2-ylmethyl)-3-piperidinecarboxamide
CID 45242821
N-cyclohexyl-2-(3-fluoro-N-[2-(1,3-thiazol-2-ylmethylamino)acetyl]anilino)-2-(2-methylphenyl)acetamide
CID 89696692
3-[1,1-difluoro-2-oxo-2-(1,3-thiazol-2-ylmethylamino)ethyl]-4-fluoro-N-(4-fluoro-3-methylphenyl)benzamide
CID 138688514

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide?
The IUPAC name of N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide (CID 87444238) is N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide.
What is the SMILES notation for N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide?
The canonical SMILES for N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide is O=C(NO)C(c1ccccc1)c1cccc(NCc2nccs2)c1.
What is the InChIKey of N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide?
The InChIKey is WQTUXMXQLFFNDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2S/c22-18(21-23)17(13-5-2-1-3-6-13)14-7-4-8-15(11-14)20-12-16-19-9-10-24-16/h1-11,17,20,23H,12H2,(H,21,22).
What are the key properties of N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide?
N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide has a molecular weight of 339.42 g/mol, XLogP of 3.39, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-phenyl-2-[3-(1,3-thiazol-2-ylmethylamino)phenyl]acetamide is sourced from PubChem (CID 87444238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).