N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide

C15H18N2O3S — CID 148951442

IUPACN-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide
SMILESCOc1ccc(CCc2nc(CCC(=O)NO)cs2)cc1
InChIInChI=1S/C15H18N2O3S/c1-20-13-6-2-11(3-7-13)4-9-15-16-12(10-21-15)5-8-14(18)17-19/h2-3,6-7,10,19H,4-5,8-9H2,1H3,(H,17,18)
InChIKeyPQAMMSYSGJYGIP-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.37
Rot. Bonds7

About N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide

N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide (PubChem CID 148951442) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide.

Molecular Properties

Compound NameN-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide
PubChem CID148951442
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide
SMILESCOc1ccc(CCc2nc(CCC(=O)NO)cs2)cc1
InChIInChI=1S/C15H18N2O3S/c1-20-13-6-2-11(3-7-13)4-9-15-16-12(10-21-15)5-8-14(18)17-19/h2-3,6-7,10,19H,4-5,8-9H2,1H3,(H,17,18)
InChIKeyPQAMMSYSGJYGIP-UHFFFAOYSA-N
XLogP2.37
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.37
H-Bond Donors ≤ 52
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

3-[2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-thiazol-4-yl]-N-hydroxypropanamide
CID 149016806
N-hydroxy-4-(4-methoxyphenyl)butanamide
CID 53384800
2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxylic acid
CID 82303210
N-(4-methoxyphenyl)-2-[2-(2-pyridin-4-ylethyl)-1,3-thiazol-4-yl]acetamide
CID 110389689
N-tert-butyl-3-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]propanamide
CID 110333309
2-[2-[(4-methoxyphenyl)methyl]-1,3-thiazol-4-yl]ethanol
CID 94268207
methyl 3-[2-(2-methoxyethyl)-1,3-thiazol-4-yl]propanoate
CID 107039799
methyl 2-[2-[3-(4-methoxyphenyl)propanoylamino]-1,3-thiazol-4-yl]acetate
CID 38987123
3-(4-methoxyphenyl)-N-[4-(methylsulfanylmethyl)-1,3-thiazol-2-yl]propanamide
CID 16850053
N-(4-butylphenyl)-3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanamide
CID 27453716
N-[[4-(diethylaminomethyl)-1,3-thiazol-2-yl]methyl]-5-(4-methoxyphenyl)pentanamide
CID 110618773
1-[2-[(4-methoxyphenyl)methyl]-1,3-thiazol-4-yl]propan-2-one
CID 115089349

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide?
The IUPAC name of N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide (CID 148951442) is N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide.
What is the SMILES notation for N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide?
The canonical SMILES for N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide is COc1ccc(CCc2nc(CCC(=O)NO)cs2)cc1.
What is the InChIKey of N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide?
The InChIKey is PQAMMSYSGJYGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-20-13-6-2-11(3-7-13)4-9-15-16-12(10-21-15)5-8-14(18)17-19/h2-3,6-7,10,19H,4-5,8-9H2,1H3,(H,17,18).
What are the key properties of N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide?
N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide has a molecular weight of 306.39 g/mol, XLogP of 2.37, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-3-[2-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]propanamide is sourced from PubChem (CID 148951442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).