2-amino-N-methoxy-5-methylbenzamide

C9H12N2O2 — CID 64974828

IUPAC2-amino-N-methoxy-5-methylbenzamide
SMILESCONC(=O)c1cc(C)ccc1N
InChIInChI=1S/C9H12N2O2/c1-6-3-4-8(10)7(5-6)9(12)11-13-2/h3-5H,10H2,1-2H3,(H,11,12)
InChIKeyWAGIVPAIQBPEGA-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.87
Rot. Bonds2

About 2-amino-N-methoxy-5-methylbenzamide

2-amino-N-methoxy-5-methylbenzamide (PubChem CID 64974828) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 2-amino-N-methoxy-5-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-methoxy-5-methylbenzamide
PubChem CID64974828
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name2-amino-N-methoxy-5-methylbenzamide
SMILESCONC(=O)c1cc(C)ccc1N
InChIInChI=1S/C9H12N2O2/c1-6-3-4-8(10)7(5-6)9(12)11-13-2/h3-5H,10H2,1-2H3,(H,11,12)
InChIKeyWAGIVPAIQBPEGA-UHFFFAOYSA-N
XLogP0.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-ethoxy-5-methylbenzamide
CID 64974666
2-amino-N-[2-(2-methoxyethoxy)ethyl]-5-methylbenzamide
CID 62511103
2-amino-N-(4-methoxy-3-methylphenyl)-5-methylbenzamide
CID 62510394
2-amino-N-(3-methoxyphenyl)-5-methylbenzamide
CID 55069541
methyl (2S)-2-[(2-amino-5-methylbenzoyl)amino]-4-methylpentanoate
CID 103954859
2-amino-5-methyl-N-(2-methylpropyl)benzamide
CID 62074325
2-amino-N-(2,2-dimethylcyclopropyl)-5-methylbenzamide
CID 62510402
2-amino-N-(2,6-dimethylphenyl)-5-methylbenzamide
CID 55083036
2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-5-methylbenzamide
CID 83108048
iodo 2-amino-5-methylbenzoate
CID 174945201
2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
CID 102695337
2-amino-N-(2-ethoxyethyl)-5-methylbenzamide
CID 62074208

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methoxy-5-methylbenzamide?
The IUPAC name of 2-amino-N-methoxy-5-methylbenzamide (CID 64974828) is 2-amino-N-methoxy-5-methylbenzamide.
What is the SMILES notation for 2-amino-N-methoxy-5-methylbenzamide?
The canonical SMILES for 2-amino-N-methoxy-5-methylbenzamide is CONC(=O)c1cc(C)ccc1N.
What is the InChIKey of 2-amino-N-methoxy-5-methylbenzamide?
The InChIKey is WAGIVPAIQBPEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-6-3-4-8(10)7(5-6)9(12)11-13-2/h3-5H,10H2,1-2H3,(H,11,12).
What are the key properties of 2-amino-N-methoxy-5-methylbenzamide?
2-amino-N-methoxy-5-methylbenzamide has a molecular weight of 180.21 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methoxy-5-methylbenzamide is sourced from PubChem (CID 64974828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).