5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide

C16H13Cl2NO2 — CID 164939975

IUPAC5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide
SMILESO=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cc(Cl)ccc1O
InChIInChI=1S/C16H13Cl2NO2/c17-10-2-4-12-9(7-10)1-5-14(12)19-16(21)13-8-11(18)3-6-15(13)20/h2-4,6-8,14,20H,1,5H2,(H,19,21)/t14-/m1/s1
InChIKeyWXWHPJKHEMYYKO-CQSZACIVSA-N
MW322.19 g/mol
LogP4.12
Rot. Bonds2

About 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide

5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide (PubChem CID 164939975) has the molecular formula C16H13Cl2NO2 and a molecular weight of 322.19 g/mol. Its IUPAC name is 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide
PubChem CID164939975
Molecular FormulaC16H13Cl2NO2
Molecular Weight322.19 g/mol
Exact Mass321.03
IUPAC Name5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide
SMILESO=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cc(Cl)ccc1O
InChIInChI=1S/C16H13Cl2NO2/c17-10-2-4-12-9(7-10)1-5-14(12)19-16(21)13-8-11(18)3-6-15(13)20/h2-4,6-8,14,20H,1,5H2,(H,19,21)/t14-/m1/s1
InChIKeyWXWHPJKHEMYYKO-CQSZACIVSA-N
XLogP4.12
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.19
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-3-methylbenzamide
CID 155283136
2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)carbamoyl]-6-fluorophenolate
CID 155718328
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-5-chloro-2-methylbenzamide
CID 82870824
1-amino-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)cyclopropane-1-carboxamide
CID 91645508
N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-5-fluoro-2,3-dihydro-1,2-benzothiazole-6-carboxamide
CID 171794326
N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-methyl-3-(methylsulfamoyl)benzamide
CID 171794448
2-amino-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)acetamide
CID 119300808
1-amino-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)cyclopentane-1-carboxamide
CID 119300818
5-chloro-2-hydroxy-N-(2-oxooxolan-3-yl)benzamide
CID 43824572
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide
CID 141027232
carbon dioxide;N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-5-fluoro-2,3-dihydro-1,2-benzothiazole-6-carboxamide
CID 171794325
(2S)-2-amino-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)propanamide;hydrochloride
CID 119300803

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide (CID 164939975) is 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide is O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide?
The InChIKey is WXWHPJKHEMYYKO-CQSZACIVSA-N. The full InChI is InChI=1S/C16H13Cl2NO2/c17-10-2-4-12-9(7-10)1-5-14(12)19-16(21)13-8-11(18)3-6-15(13)20/h2-4,6-8,14,20H,1,5H2,(H,19,21)/t14-/m1/s1.
What are the key properties of 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide?
5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide has a molecular weight of 322.19 g/mol, XLogP of 4.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1R)-5-chloro-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide is sourced from PubChem (CID 164939975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).