2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide

C11H15ClN2O2 — CID 65103861

IUPAC2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide
SMILESCC(C)(O)CNC(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C11H15ClN2O2/c1-11(2,16)6-14-10(15)8-5-7(12)3-4-9(8)13/h3-5,16H,6,13H2,1-2H3,(H,14,15)
InChIKeyOVCPJZVVOFDIRY-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.42
Rot. Bonds3

About 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide

2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide (PubChem CID 65103861) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide
PubChem CID65103861
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide
SMILESCC(C)(O)CNC(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C11H15ClN2O2/c1-11(2,16)6-14-10(15)8-5-7(12)3-4-9(8)13/h3-5,16H,6,13H2,1-2H3,(H,14,15)
InChIKeyOVCPJZVVOFDIRY-UHFFFAOYSA-N
XLogP1.42
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-5-chloro-N-(2,2-dimethylbutyl)benzamide
CID 103459946
2,4-dichloro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65109953
2-amino-5-chloro-N-(3,3-dimethylbutyl)benzamide
CID 115597357
5-chloro-N-(2-hydroxy-2-methylpropyl)-2-nitrobenzamide
CID 65107531
2-amino-N-(2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)benzamide
CID 70098587
2-amino-N-(2-amino-2-oxoethyl)-5-chlorobenzamide
CID 16778185
2-amino-N-(2-hydroxy-2-methylpropyl)-5-(2-methoxyethoxy)benzamide
CID 70098352
N-(3-bromo-2,2-dimethylpropyl)-2,5-dichlorobenzamide
CID 115364763
4-amino-2-fluoro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65104066
2-amino-5-chloro-N-[(1-methylcyclopentyl)methyl]benzamide
CID 63821646
2,5-dichloro-N-(3-chloro-2,2-dimethylpropyl)benzamide
CID 115364431
2-amino-5-chloro-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]benzamide
CID 107843370

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide?
The IUPAC name of 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide (CID 65103861) is 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide.
What is the SMILES notation for 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide?
The canonical SMILES for 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide is CC(C)(O)CNC(=O)c1cc(Cl)ccc1N.
What is the InChIKey of 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide?
The InChIKey is OVCPJZVVOFDIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-11(2,16)6-14-10(15)8-5-7(12)3-4-9(8)13/h3-5,16H,6,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide?
2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide has a molecular weight of 242.71 g/mol, XLogP of 1.42, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide is sourced from PubChem (CID 65103861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).