N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide

C11H13NO3 — CID 107722324

IUPACN-cyclopropyl-2,5-dihydroxy-N-methylbenzamide
SMILESCN(C(=O)c1cc(O)ccc1O)C1CC1
InChIInChI=1S/C11H13NO3/c1-12(7-2-3-7)11(15)9-6-8(13)4-5-10(9)14/h4-7,13-14H,2-3H2,1H3
InChIKeyREJFYSBJCYQUBR-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.33
Rot. Bonds2

About N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide

N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide (PubChem CID 107722324) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2,5-dihydroxy-N-methylbenzamide
PubChem CID107722324
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC NameN-cyclopropyl-2,5-dihydroxy-N-methylbenzamide
SMILESCN(C(=O)c1cc(O)ccc1O)C1CC1
InChIInChI=1S/C11H13NO3/c1-12(7-2-3-7)11(15)9-6-8(13)4-5-10(9)14/h4-7,13-14H,2-3H2,1H3
InChIKeyREJFYSBJCYQUBR-UHFFFAOYSA-N
XLogP1.33
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(azetidin-3-yl)-2,5-dihydroxy-N-methylbenzamide
CID 107725203
N-[4-(ethylamino)cyclohexyl]-2,5-dihydroxy-N-methylbenzamide
CID 107721216
N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
CID 103863729
N-cyclopropyl-2-fluoro-4-hydroxy-N-methylbenzamide
CID 103940160
2-hydroxy-5-iodo-N-methyl-N-(4-methylcyclohexyl)benzamide
CID 103606106
N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide
CID 43409240
N-cyclobutyl-2-fluoro-4-hydroxy-N-methylbenzamide
CID 103940219
N-cyclopropyl-N-(cyclopropylmethyl)-2,5-dihydroxybenzamide
CID 107723158
N-butyl-N-cyclopropyl-2,5-dihydroxybenzamide
CID 103891986
N-cyclopropyl-4-hydroxy-N-methylbenzamide
CID 43265196
N-(8-azabicyclo[3.2.1]octan-3-yl)-2,4-dihydroxy-N-methylbenzamide
CID 61232206
N-(azepan-4-yl)-5-chloro-2-hydroxy-N-methylbenzamide
CID 107172538

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide?
The IUPAC name of N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide (CID 107722324) is N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide?
The canonical SMILES for N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide is CN(C(=O)c1cc(O)ccc1O)C1CC1.
What is the InChIKey of N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide?
The InChIKey is REJFYSBJCYQUBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-12(7-2-3-7)11(15)9-6-8(13)4-5-10(9)14/h4-7,13-14H,2-3H2,1H3.
What are the key properties of N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide?
N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide has a molecular weight of 207.23 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide is sourced from PubChem (CID 107722324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).