2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide

C12H16N2O2 — CID 107076024

IUPAC2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide
SMILESCC1CC(NC(=O)c2cc(O)ccc2N)C1
InChIInChI=1S/C12H16N2O2/c1-7-4-8(5-7)14-12(16)10-6-9(15)2-3-11(10)13/h2-3,6-8,15H,4-5,13H2,1H3,(H,14,16)
InChIKeyQHCSTSHQNODJLI-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.50
Rot. Bonds2

About 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide

2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide (PubChem CID 107076024) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide.

Molecular Properties

Compound Name2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide
PubChem CID107076024
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide
SMILESCC1CC(NC(=O)c2cc(O)ccc2N)C1
InChIInChI=1S/C12H16N2O2/c1-7-4-8(5-7)14-12(16)10-6-9(15)2-3-11(10)13/h2-3,6-8,15H,4-5,13H2,1H3,(H,14,16)
InChIKeyQHCSTSHQNODJLI-UHFFFAOYSA-N
XLogP1.50
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
CID 107723193
2-amino-N-(2,2-dimethyloxan-4-yl)-5-hydroxybenzamide
CID 107075856
2-amino-5-hydroxy-N-(2-methylcyclopentyl)benzamide
CID 107075272
2,5-dihydroxy-N-(3-methylcyclopentyl)benzamide
CID 107723891
2-amino-N-(3,5-dimethylcyclohexyl)-4-methoxybenzamide
CID 115413365
2-amino-5-hydroxy-N-(2-methyloxolan-3-yl)benzamide
CID 107075822
2-amino-5-hydroxy-N-(1-methylsulfonylpiperidin-4-yl)benzamide
CID 107074192
2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
CID 115671067
2-amino-4-chloro-N-(3,5-dimethylcyclohexyl)benzamide
CID 64734584
2-amino-5-hydroxy-N-(5-oxo-1-propylpyrrolidin-3-yl)benzamide
CID 131944350
4-amino-3-chloro-N-(3,5-dimethylcyclohexyl)benzamide
CID 64733696
N-(4-acetamidophenyl)-2-amino-5-hydroxybenzamide
CID 107073912

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide?
The IUPAC name of 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide (CID 107076024) is 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide.
What is the SMILES notation for 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide?
The canonical SMILES for 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide is CC1CC(NC(=O)c2cc(O)ccc2N)C1.
What is the InChIKey of 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide?
The InChIKey is QHCSTSHQNODJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-7-4-8(5-7)14-12(16)10-6-9(15)2-3-11(10)13/h2-3,6-8,15H,4-5,13H2,1H3,(H,14,16).
What are the key properties of 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide?
2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide has a molecular weight of 220.27 g/mol, XLogP of 1.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide is sourced from PubChem (CID 107076024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).