N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide

C13H14N2O3S — CID 167969899

IUPACN-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ncc(CCO)s1
InChIInChI=1S/C13H14N2O3S/c1-18-11-5-3-2-4-10(11)12(17)15-13-14-8-9(19-13)6-7-16/h2-5,8,16H,6-7H2,1H3,(H,14,15,17)
InChIKeyQMXAVBDQTDEUJR-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.94
Rot. Bonds5

About N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide

N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide (PubChem CID 167969899) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
PubChem CID167969899
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC NameN-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ncc(CCO)s1
InChIInChI=1S/C13H14N2O3S/c1-18-11-5-3-2-4-10(11)12(17)15-13-14-8-9(19-13)6-7-16/h2-5,8,16H,6-7H2,1H3,(H,14,15,17)
InChIKeyQMXAVBDQTDEUJR-UHFFFAOYSA-N
XLogP1.94
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 803477
N-(5-cyclopropyl-1,3-thiazol-2-yl)-2-methoxybenzamide
CID 155951835
2-methoxy-N-[5-(oxan-4-yl)-1,3-thiazol-2-yl]benzamide
CID 167932235
N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-propoxybenzamide
CID 4651810
N-(5-benzyl-1,3-thiazol-2-yl)-2-butoxybenzamide
CID 4254438
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-methoxybenzamide
CID 40535473
N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2,3-dimethoxybenzamide
CID 42027870
2-methoxy-N-[5-[2-[2-[5-[(2-methoxybenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethylsulfanyl]ethyl]-1,3,4-thiadiazol-2-yl]benzamide
CID 3112374
N-(5-benzyl-1,3-thiazol-2-yl)-2-(difluoromethoxy)benzamide
CID 42999638
ethyl 2-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 54138651
2-propan-2-yloxy-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-2-yl]benzamide
CID 4306708
N-[5-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-ethoxybenzamide
CID 3497765

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide?
The IUPAC name of N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide (CID 167969899) is N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide.
What is the SMILES notation for N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide?
The canonical SMILES for N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ncc(CCO)s1.
What is the InChIKey of N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide?
The InChIKey is QMXAVBDQTDEUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-18-11-5-3-2-4-10(11)12(17)15-13-14-8-9(19-13)6-7-16/h2-5,8,16H,6-7H2,1H3,(H,14,15,17).
What are the key properties of N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide?
N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide has a molecular weight of 278.33 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-2-methoxybenzamide is sourced from PubChem (CID 167969899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).