2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide

C10H11Cl2NO2 — CID 83031874

IUPAC2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
SMILESC[C@@H](O)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H11Cl2NO2/c1-6(14)5-13-10(15)8-4-7(11)2-3-9(8)12/h2-4,6,14H,5H2,1H3,(H,13,15)/t6-/m1/s1
InChIKeyGXGGIKXSRUJNBA-ZCFIWIBFSA-N
MW248.11 g/mol
LogP2.10
Rot. Bonds3

About 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide

2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide (PubChem CID 83031874) has the molecular formula C10H11Cl2NO2 and a molecular weight of 248.11 g/mol. Its IUPAC name is 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
PubChem CID83031874
Molecular FormulaC10H11Cl2NO2
Molecular Weight248.11 g/mol
Exact Mass247.02
IUPAC Name2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
SMILESC[C@@H](O)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H11Cl2NO2/c1-6(14)5-13-10(15)8-4-7(11)2-3-9(8)12/h2-4,6,14H,5H2,1H3,(H,13,15)/t6-/m1/s1
InChIKeyGXGGIKXSRUJNBA-ZCFIWIBFSA-N
XLogP2.10
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.11
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-(2-methoxypropyl)benzamide
CID 101005301
N-(4-bromo-2-methylbutyl)-2,5-dichlorobenzamide
CID 114316716
4-chloro-2,5-difluoro-N-(2-hydroxypropyl)benzamide
CID 82771930
5-chloro-N-(2-hydroxy-3-methylbutyl)-2-iodobenzamide
CID 113268309
2-(2,5-dichlorophenyl)sulfanyl-N-[(2S)-2-hydroxypropyl]acetamide
CID 83029637
2-amino-5-chloro-N-(2-hydroxypropyl)-3-methylbenzamide
CID 69132143
2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
CID 103725481
2,5-dichloro-N-[2-(methylamino)ethyl]benzamide
CID 62659102
3-[(2,4-dichlorobenzoyl)amino]-2-methylpropanoic acid
CID 62676717
N-(2-bromo-2-phenylethyl)-2,5-dichlorobenzamide
CID 114308255
2,5-dichloro-N-(1,1-dideuterio-2-oxopropyl)benzamide
CID 159122733
3-chloro-N-[(2S)-2-hydroxypropyl]pyridine-4-carboxamide
CID 83030867

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide (CID 83031874) is 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide is C[C@@H](O)CNC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide?
The InChIKey is GXGGIKXSRUJNBA-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H11Cl2NO2/c1-6(14)5-13-10(15)8-4-7(11)2-3-9(8)12/h2-4,6,14H,5H2,1H3,(H,13,15)/t6-/m1/s1.
What are the key properties of 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide?
2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide has a molecular weight of 248.11 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide is sourced from PubChem (CID 83031874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).