2-amino-4-methoxybenzamide

C8H10N2O2 — CID 14023002

IUPAC2-amino-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)c(N)c1
InChIInChI=1S/C8H10N2O2/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H2,10,11)
InChIKeyFNXZMHNQECQCNX-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.38
Rot. Bonds2

About 2-amino-4-methoxybenzamide

2-amino-4-methoxybenzamide (PubChem CID 14023002) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-amino-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-4-methoxybenzamide
PubChem CID14023002
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name2-amino-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)c(N)c1
InChIInChI=1S/C8H10N2O2/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H2,10,11)
InChIKeyFNXZMHNQECQCNX-UHFFFAOYSA-N
XLogP0.38
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxybenzamide?
The IUPAC name of 2-amino-4-methoxybenzamide (CID 14023002) is 2-amino-4-methoxybenzamide.
What is the SMILES notation for 2-amino-4-methoxybenzamide?
The canonical SMILES for 2-amino-4-methoxybenzamide is COc1ccc(C(N)=O)c(N)c1.
What is the InChIKey of 2-amino-4-methoxybenzamide?
The InChIKey is FNXZMHNQECQCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4H,9H2,1H3,(H2,10,11).
What are the key properties of 2-amino-4-methoxybenzamide?
2-amino-4-methoxybenzamide has a molecular weight of 166.18 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxybenzamide is sourced from PubChem (CID 14023002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).