2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide

C11H13Cl2NO3 — CID 96525639

IUPAC2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@H](C)NC(=O)c1c(O)cc(Cl)cc1Cl
InChIInChI=1S/C11H13Cl2NO3/c1-6(5-17-2)14-11(16)10-8(13)3-7(12)4-9(10)15/h3-4,6,15H,5H2,1-2H3,(H,14,16)/t6-/m0/s1
InChIKeyALTOZRJWPVDJPL-LURJTMIESA-N
MW278.13 g/mol
LogP2.46
Rot. Bonds4

About 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide

2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide (PubChem CID 96525639) has the molecular formula C11H13Cl2NO3 and a molecular weight of 278.13 g/mol. Its IUPAC name is 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide
PubChem CID96525639
Molecular FormulaC11H13Cl2NO3
Molecular Weight278.13 g/mol
Exact Mass277.03
IUPAC Name2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@H](C)NC(=O)c1c(O)cc(Cl)cc1Cl
InChIInChI=1S/C11H13Cl2NO3/c1-6(5-17-2)14-11(16)10-8(13)3-7(12)4-9(10)15/h3-4,6,15H,5H2,1-2H3,(H,14,16)/t6-/m0/s1
InChIKeyALTOZRJWPVDJPL-LURJTMIESA-N
XLogP2.46
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.13
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-N-(1-cyanopropan-2-yl)-6-hydroxybenzamide
CID 75424748
3,5-dichloro-N-[(2R)-1-methoxypropan-2-yl]benzamide
CID 30481549
2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide
CID 103748891
2,4-dichloro-6-hydroxy-N-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]benzamide
CID 97234757
2,4-dichloro-6-hydroxy-N-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]benzamide
CID 97234758
2,4-dichloro-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)propan-2-yl]-6-hydroxybenzamide
CID 71860642
3-bromo-5-chloro-N-(1-methoxypropan-2-yl)benzamide
CID 103826410
3-chloro-5-(1-methoxypropan-2-ylcarbamoyl)benzenesulfonyl chloride
CID 65368353
4-amino-3,5-dichloro-N-(1-methoxypropan-2-yl)benzamide
CID 82787029
2-chloro-4,5-difluoro-N-(1-methoxypropan-2-yl)benzamide
CID 51072684
2,4-dichloro-5-fluoro-N-[(2S)-1-methoxypropan-2-yl]benzamide
CID 30481632
2,4-dichloro-N-(1-methoxypropan-2-yl)-5-sulfamoylbenzamide
CID 60637644

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide?
The IUPAC name of 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide (CID 96525639) is 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide.
What is the SMILES notation for 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide?
The canonical SMILES for 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide is COC[C@H](C)NC(=O)c1c(O)cc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide?
The InChIKey is ALTOZRJWPVDJPL-LURJTMIESA-N. The full InChI is InChI=1S/C11H13Cl2NO3/c1-6(5-17-2)14-11(16)10-8(13)3-7(12)4-9(10)15/h3-4,6,15H,5H2,1-2H3,(H,14,16)/t6-/m0/s1.
What are the key properties of 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide?
2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide has a molecular weight of 278.13 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide is sourced from PubChem (CID 96525639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).