4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide

C12H11ClN2O3 — CID 65488539

IUPAC4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
SMILESCc1noc(NC(=O)c2ccc(Cl)cc2O)c1C
InChIInChI=1S/C12H11ClN2O3/c1-6-7(2)15-18-12(6)14-11(17)9-4-3-8(13)5-10(9)16/h3-5,16H,1-2H3,(H,14,17)
InChIKeyNZJUTDHPPZBOTO-UHFFFAOYSA-N
MW266.68 g/mol
LogP2.90
Rot. Bonds2

About 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide

4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide (PubChem CID 65488539) has the molecular formula C12H11ClN2O3 and a molecular weight of 266.68 g/mol. Its IUPAC name is 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
PubChem CID65488539
Molecular FormulaC12H11ClN2O3
Molecular Weight266.68 g/mol
Exact Mass266.05
IUPAC Name4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
SMILESCc1noc(NC(=O)c2ccc(Cl)cc2O)c1C
InChIInChI=1S/C12H11ClN2O3/c1-6-7(2)15-18-12(6)14-11(17)9-4-3-8(13)5-10(9)16/h3-5,16H,1-2H3,(H,14,17)
InChIKeyNZJUTDHPPZBOTO-UHFFFAOYSA-N
XLogP2.90
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.68
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzamide
CID 103722577
4-bromo-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
CID 65488541
5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methyl-1H-indole-2-carboxamide
CID 155913457
3-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
CID 113386525
2-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)-5-methylbenzamide
CID 65486415
2,5-dibromo-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzamide
CID 114372486
2-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)quinoline-4-carboxamide
CID 65486238
3,6-dichloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)pyridine-2-carboxamide
CID 65486049
4-chloro-2-hydroxy-N-(4-methylpyrimidin-2-yl)benzamide
CID 6481030
2-bromo-N-(3,4-dimethyl-1,2-oxazol-5-yl)-5-fluorobenzamide
CID 65488531
2-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylbenzamide
CID 65488700
3-[(3,4-dimethyl-1,2-oxazol-5-yl)carbamoyl]benzoic acid
CID 65482154

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide?
The IUPAC name of 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide (CID 65488539) is 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide is Cc1noc(NC(=O)c2ccc(Cl)cc2O)c1C.
What is the InChIKey of 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide?
The InChIKey is NZJUTDHPPZBOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3/c1-6-7(2)15-18-12(6)14-11(17)9-4-3-8(13)5-10(9)16/h3-5,16H,1-2H3,(H,14,17).
What are the key properties of 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide?
4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide has a molecular weight of 266.68 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide is sourced from PubChem (CID 65488539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).