2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide

C16H18N2O3 — CID 115413114

IUPAC2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
SMILESCOc1cccc(N(C)C(=O)c2ccc(OC)cc2N)c1
InChIInChI=1S/C16H18N2O3/c1-18(11-5-4-6-12(9-11)20-2)16(19)14-8-7-13(21-3)10-15(14)17/h4-10H,17H2,1-3H3
InChIKeyFPROVSXVELJDLX-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.56
Rot. Bonds4

About 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide

2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide (PubChem CID 115413114) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide.

Molecular Properties

Compound Name2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
PubChem CID115413114
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
SMILESCOc1cccc(N(C)C(=O)c2ccc(OC)cc2N)c1
InChIInChI=1S/C16H18N2O3/c1-18(11-5-4-6-12(9-11)20-2)16(19)14-8-7-13(21-3)10-15(14)17/h4-10H,17H2,1-3H3
InChIKeyFPROVSXVELJDLX-UHFFFAOYSA-N
XLogP2.56
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-4-fluoro-N-(3-methoxyphenyl)-N-methylbenzamide
CID 63110478
4-fluoro-2-hydroxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 107015204
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
N-(3-aminophenyl)-2-fluoro-4-methoxy-N-methylbenzamide
CID 102881879
2-amino-3-fluoro-N-(3-methoxyphenyl)-N-methylpyridine-4-carboxamide
CID 105385330
4-(4-methoxyphenoxy)-N-(3-methoxyphenyl)-N-methylbenzamide
CID 127038740
2-fluoro-N-(3-fluorophenyl)-4-methoxy-N-methylbenzamide
CID 103774616
2-amino-N-ethyl-4-methoxy-N-phenylbenzamide
CID 115412453
2-hydroxy-N-(3-methoxyphenyl)-N-methylacetamide
CID 70581132
2-chloro-N-(3-methoxyphenyl)-N-methylfuran-3-carboxamide
CID 106686697
3-bromo-2-fluoro-N-(3-methoxyphenyl)-N-methylbenzamide
CID 107952292
4-[(3-methoxyphenyl)-methylcarbamoyl]benzoic acid
CID 62003468

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The IUPAC name of 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide (CID 115413114) is 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide.
What is the SMILES notation for 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The canonical SMILES for 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide is COc1cccc(N(C)C(=O)c2ccc(OC)cc2N)c1.
What is the InChIKey of 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The InChIKey is FPROVSXVELJDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-18(11-5-4-6-12(9-11)20-2)16(19)14-8-7-13(21-3)10-15(14)17/h4-10H,17H2,1-3H3.
What are the key properties of 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide has a molecular weight of 286.33 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide is sourced from PubChem (CID 115413114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).