2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide

C12H16N2O2 — CID 115413150

IUPAC2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide
SMILESCOc1ccc(C(=O)NC2CC2C)c(N)c1
InChIInChI=1S/C12H16N2O2/c1-7-5-11(7)14-12(15)9-4-3-8(16-2)6-10(9)13/h3-4,6-7,11H,5,13H2,1-2H3,(H,14,15)
InChIKeyOZQBIPPCHAXMBV-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.42
Rot. Bonds3

About 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide

2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide (PubChem CID 115413150) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide.

Molecular Properties

Compound Name2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide
PubChem CID115413150
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide
SMILESCOc1ccc(C(=O)NC2CC2C)c(N)c1
InChIInChI=1S/C12H16N2O2/c1-7-5-11(7)14-12(15)9-4-3-8(16-2)6-10(9)13/h3-4,6-7,11H,5,13H2,1-2H3,(H,14,15)
InChIKeyOZQBIPPCHAXMBV-UHFFFAOYSA-N
XLogP1.42
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.42
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

2-amino-4-methoxy-N-(2-methylcyclopentyl)benzamide
CID 115413242
2-amino-N-(2,3-dimethylcyclopentyl)-4-methoxybenzamide
CID 115413379
2-amino-N-(3,5-dimethylcyclohexyl)-4-methoxybenzamide
CID 115413365
2-amino-4-chloro-N-(2-methylcyclopropyl)benzamide
CID 62398884
2-amino-N-[2-(hydroxymethyl)cyclohexyl]-4-methoxybenzamide
CID 106361507
2-amino-4-methoxy-N-(oxan-4-yl)benzamide
CID 89025989
2-amino-N-hydroxy-4-methoxybenzamide
CID 115413301
2-amino-N-(4-carbamoylcyclohexyl)-4-methoxybenzamide
CID 115412622
N-(2-aminocyclopropyl)-2-hydroxy-4-methoxybenzamide
CID 43593875
2-amino-4-methoxy-N-propan-2-ylbenzamide
CID 14274445
2-amino-N-(dicyclopropylmethyl)-4-methoxybenzamide
CID 115412967
N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide
CID 103804989

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide?
The IUPAC name of 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide (CID 115413150) is 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide.
What is the SMILES notation for 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide?
The canonical SMILES for 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide is COc1ccc(C(=O)NC2CC2C)c(N)c1.
What is the InChIKey of 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide?
The InChIKey is OZQBIPPCHAXMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-7-5-11(7)14-12(15)9-4-3-8(16-2)6-10(9)13/h3-4,6-7,11H,5,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide?
2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide has a molecular weight of 220.27 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxy-N-(2-methylcyclopropyl)benzamide is sourced from PubChem (CID 115413150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).