N-methoxy-2-methylisoindole-5-carboxamide

C11H12N2O2 — CID 134393881

IUPACN-methoxy-2-methylisoindole-5-carboxamide
SMILESCONC(=O)c1ccc2cn(C)cc2c1
InChIInChI=1S/C11H12N2O2/c1-13-6-9-4-3-8(5-10(9)7-13)11(14)12-15-2/h3-7H,1-2H3,(H,12,14)
InChIKeyHROWFOQBEZJELG-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.47
Rot. Bonds2

About N-methoxy-2-methylisoindole-5-carboxamide

N-methoxy-2-methylisoindole-5-carboxamide (PubChem CID 134393881) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is N-methoxy-2-methylisoindole-5-carboxamide.

Molecular Properties

Compound NameN-methoxy-2-methylisoindole-5-carboxamide
PubChem CID134393881
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC NameN-methoxy-2-methylisoindole-5-carboxamide
SMILESCONC(=O)c1ccc2cn(C)cc2c1
InChIInChI=1S/C11H12N2O2/c1-13-6-9-4-3-8(5-10(9)7-13)11(14)12-15-2/h3-7H,1-2H3,(H,12,14)
InChIKeyHROWFOQBEZJELG-UHFFFAOYSA-N
XLogP1.47
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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3-(chloroamino)-N-methoxy-4-methylbenzamide
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4-(2-aminoethyl)-N-methoxybenzamide
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6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-N-methoxynaphthalene-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-methylisoindole-5-carboxamide?
The IUPAC name of N-methoxy-2-methylisoindole-5-carboxamide (CID 134393881) is N-methoxy-2-methylisoindole-5-carboxamide.
What is the SMILES notation for N-methoxy-2-methylisoindole-5-carboxamide?
The canonical SMILES for N-methoxy-2-methylisoindole-5-carboxamide is CONC(=O)c1ccc2cn(C)cc2c1.
What is the InChIKey of N-methoxy-2-methylisoindole-5-carboxamide?
The InChIKey is HROWFOQBEZJELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-13-6-9-4-3-8(5-10(9)7-13)11(14)12-15-2/h3-7H,1-2H3,(H,12,14).
What are the key properties of N-methoxy-2-methylisoindole-5-carboxamide?
N-methoxy-2-methylisoindole-5-carboxamide has a molecular weight of 204.23 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-methylisoindole-5-carboxamide is sourced from PubChem (CID 134393881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).