N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide

C14H9ClN2O3 — CID 175430925

IUPACN-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1ccc2ncoc2c1)c1cc(Cl)ccc1O
InChIInChI=1S/C14H9ClN2O3/c15-8-1-4-12(18)10(5-8)14(19)17-9-2-3-11-13(6-9)20-7-16-11/h1-7,18H,(H,17,19)
InChIKeyILZBOJRRJGZASI-UHFFFAOYSA-N
MW288.69 g/mol
LogP3.44
Rot. Bonds2

About N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide

N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide (PubChem CID 175430925) has the molecular formula C14H9ClN2O3 and a molecular weight of 288.69 g/mol. Its IUPAC name is N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide
PubChem CID175430925
Molecular FormulaC14H9ClN2O3
Molecular Weight288.69 g/mol
Exact Mass288.03
IUPAC NameN-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1ccc2ncoc2c1)c1cc(Cl)ccc1O
InChIInChI=1S/C14H9ClN2O3/c15-8-1-4-12(18)10(5-8)14(19)17-9-2-3-11-13(6-9)20-7-16-11/h1-7,18H,(H,17,19)
InChIKeyILZBOJRRJGZASI-UHFFFAOYSA-N
XLogP3.44
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.69
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chlorophenyl)-1,3-benzoxazole-6-carboxamide
CID 110765115
5-chloro-N-(2-chloropyrimidin-5-yl)-2-hydroxybenzamide
CID 121352747
1,3-benzoxazol-6-ylcarbamic acid
CID 115170663
N-(1,3-benzoxazol-6-yl)acetamide
CID 54228397
N-(1,3-benzoxazol-6-yl)-2-chloro-6-fluorobenzamide
CID 110728878
N-(1,3-benzoxazol-6-yl)-4-(methylamino)benzamide
CID 115161080
N-(1,3-benzoxazol-6-yl)pyrazine-2-carboxamide
CID 110744615
5-chloro-2-hydroxy-N-(2-methylpyrimidin-5-yl)benzamide
CID 167975567
N-(3-amino-4-bromophenyl)-5-chloro-2-hydroxybenzamide
CID 79767581
N-(1,3-benzoxazol-6-yl)thiophene-2-carboxamide
CID 110728841
N-(3-chloro-4-methylphenyl)-1,3-benzoxazole-6-carboxamide
CID 110859301
5-chloro-N-[4-(4-chlorophenoxy)phenyl]-2-hydroxybenzamide
CID 163300797

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide (CID 175430925) is N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide is O=C(Nc1ccc2ncoc2c1)c1cc(Cl)ccc1O.
What is the InChIKey of N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide?
The InChIKey is ILZBOJRRJGZASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O3/c15-8-1-4-12(18)10(5-8)14(19)17-9-2-3-11-13(6-9)20-7-16-11/h1-7,18H,(H,17,19).
What are the key properties of N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide?
N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide has a molecular weight of 288.69 g/mol, XLogP of 3.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 175430925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).