5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide

C12H15ClN2O3 — CID 43402430

IUPAC5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
SMILESCC(C)NC(=O)CNC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C12H15ClN2O3/c1-7(2)15-11(17)6-14-12(18)9-5-8(13)3-4-10(9)16/h3-5,7,16H,6H2,1-2H3,(H,14,18)(H,15,17)
InChIKeyYIKGWOFSXVDXOE-UHFFFAOYSA-N
MW270.72 g/mol
LogP1.30
Rot. Bonds4

About 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide

5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide (PubChem CID 43402430) has the molecular formula C12H15ClN2O3 and a molecular weight of 270.72 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
PubChem CID43402430
Molecular FormulaC12H15ClN2O3
Molecular Weight270.72 g/mol
Exact Mass270.08
IUPAC Name5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
SMILESCC(C)NC(=O)CNC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C12H15ClN2O3/c1-7(2)15-11(17)6-14-12(18)9-5-8(13)3-4-10(9)16/h3-5,7,16H,6H2,1-2H3,(H,14,18)(H,15,17)
InChIKeyYIKGWOFSXVDXOE-UHFFFAOYSA-N
XLogP1.30
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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5-chloro-N-(1-chloropropan-2-yl)-2-hydroxybenzamide
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5-chloro-N-(2-ethylbutyl)-2-hydroxybenzamide
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2,5-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 9299876
CID 123415418
CID 123415418
5-chloro-2-[[2-oxo-2-(propan-2-ylamino)ethyl]carbamoylamino]benzoic acid
CID 61203622
2-bromo-5-chloro-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 113221942
3-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-4-methylpentanoic acid
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CID 47308839

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide (CID 43402430) is 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide is CC(C)NC(=O)CNC(=O)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
The InChIKey is YIKGWOFSXVDXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O3/c1-7(2)15-11(17)6-14-12(18)9-5-8(13)3-4-10(9)16/h3-5,7,16H,6H2,1-2H3,(H,14,18)(H,15,17).
What are the key properties of 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide?
5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide has a molecular weight of 270.72 g/mol, XLogP of 1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide is sourced from PubChem (CID 43402430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).