N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide

C13H19ClN2O2 — CID 106502689

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide
SMILESCC(C)C(C)(CN)NC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-8(2)13(3,7-15)16-12(18)10-6-9(17)4-5-11(10)14/h4-6,8,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyQIIWWXQFFCMSQX-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.15
Rot. Bonds4

About N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide

N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide (PubChem CID 106502689) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide
PubChem CID106502689
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide
SMILESCC(C)C(C)(CN)NC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-8(2)13(3,7-15)16-12(18)10-6-9(17)4-5-11(10)14/h4-6,8,17H,7,15H2,1-3H3,(H,16,18)
InChIKeyQIIWWXQFFCMSQX-UHFFFAOYSA-N
XLogP2.15
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-(2-methylpropanoylamino)benzamide;hydrochloride
CID 119609082
N-(1-amino-2,3-dimethylbutan-2-yl)-2-chlorofuran-3-carboxamide
CID 106688596
N-(1-amino-2,3-dimethylbutan-2-yl)-4-bromo-2-chlorobenzamide
CID 81487258
N-(1-amino-2,3-dimethylbutan-2-yl)-5-chloro-2-methylbenzamide
CID 82882950
N-(1-amino-2,3-dimethylbutan-2-yl)-4-chloro-3-methylbenzamide
CID 112701453
N-(1-amino-2,3-dimethylbutan-2-yl)-2,5-dimethylbenzamide
CID 81485961
2-chloro-N-(4-chloro-2-methylbutan-2-yl)-5-hydroxybenzamide
CID 106503218
2-chloro-N-(1-chloro-2-methylbutan-2-yl)-5-hydroxybenzamide
CID 106503133
N-(1-amino-2,3-dimethylbutan-2-yl)-2-iodo-4-methoxybenzamide
CID 119605873
N-(1-amino-2,3-dimethylbutan-2-yl)-2,4-dimethoxybenzamide;hydrochloride
CID 119606880
N-(1-amino-2,3-dimethylbutan-2-yl)-5-hydroxypyridine-3-carboxamide
CID 113283967
N-(1-amino-2,3-dimethylbutan-2-yl)-2-fluoro-4-methoxybenzamide;hydrochloride
CID 119607834

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide (CID 106502689) is N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide is CC(C)C(C)(CN)NC(=O)c1cc(O)ccc1Cl.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide?
The InChIKey is QIIWWXQFFCMSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-8(2)13(3,7-15)16-12(18)10-6-9(17)4-5-11(10)14/h4-6,8,17H,7,15H2,1-3H3,(H,16,18).
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide?
N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide has a molecular weight of 270.76 g/mol, XLogP of 2.15, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-2-chloro-5-hydroxybenzamide is sourced from PubChem (CID 106502689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).