N-(5-amino-2-methoxyphenyl)-2-methylpropanamide

C11H16N2O2 — CID 16772178

IUPACN-(5-amino-2-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(N)cc1NC(=O)C(C)C
InChIInChI=1S/C11H16N2O2/c1-7(2)11(14)13-9-6-8(12)4-5-10(9)15-3/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNBPZVRARPFVXMJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.87
Rot. Bonds3

About N-(5-amino-2-methoxyphenyl)-2-methylpropanamide

N-(5-amino-2-methoxyphenyl)-2-methylpropanamide (PubChem CID 16772178) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(5-amino-2-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-amino-2-methoxyphenyl)-2-methylpropanamide
PubChem CID16772178
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-(5-amino-2-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(N)cc1NC(=O)C(C)C
InChIInChI=1S/C11H16N2O2/c1-7(2)11(14)13-9-6-8(12)4-5-10(9)15-3/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNBPZVRARPFVXMJ-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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4-methoxy-3-(2-methylpropanoylamino)benzoic acid
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N-(5-amino-2-methoxyphenyl)-2-[1-methoxypropan-2-yl(methyl)amino]propanamide
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N-(5-amino-2-methoxyphenyl)-2-(3-methoxypropoxy)propanamide
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N-(5-amino-2-methoxyphenyl)-2-[ethyl(propyl)amino]propanamide
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[5-amino-2-(2-methylpropanoylamino)phenyl] 2-methylpropanoate;hydrochloride
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N-(5-benzoyl-2-methoxyphenyl)-2-methylpropanamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(5-amino-2-methoxyphenyl)-2-methylpropanamide (CID 16772178) is N-(5-amino-2-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(5-amino-2-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(5-amino-2-methoxyphenyl)-2-methylpropanamide is COc1ccc(N)cc1NC(=O)C(C)C.
What is the InChIKey of N-(5-amino-2-methoxyphenyl)-2-methylpropanamide?
The InChIKey is NBPZVRARPFVXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(2)11(14)13-9-6-8(12)4-5-10(9)15-3/h4-7H,12H2,1-3H3,(H,13,14).
What are the key properties of N-(5-amino-2-methoxyphenyl)-2-methylpropanamide?
N-(5-amino-2-methoxyphenyl)-2-methylpropanamide has a molecular weight of 208.26 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 16772178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).