2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide

C15H23N3O3 — CID 114399024

IUPAC2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide
SMILESCCN1CCOC(CNC(=O)c2c(N)cccc2OC)C1
InChIInChI=1S/C15H23N3O3/c1-3-18-7-8-21-11(10-18)9-17-15(19)14-12(16)5-4-6-13(14)20-2/h4-6,11H,3,7-10,16H2,1-2H3,(H,17,19)
InChIKeyZKRZVNFTCGBWMU-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.73
Rot. Bonds5

About 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide

2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide (PubChem CID 114399024) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide
PubChem CID114399024
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide
SMILESCCN1CCOC(CNC(=O)c2c(N)cccc2OC)C1
InChIInChI=1S/C15H23N3O3/c1-3-18-7-8-21-11(10-18)9-17-15(19)14-12(16)5-4-6-13(14)20-2/h4-6,11H,3,7-10,16H2,1-2H3,(H,17,19)
InChIKeyZKRZVNFTCGBWMU-UHFFFAOYSA-N
XLogP0.73
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methylbenzamide
CID 114398978
2,6-dimethoxy-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 110710223
N-[(4-ethylmorpholin-2-yl)methyl]-3-hydroxy-2-methylbenzamide
CID 115869037
3-amino-4-bromo-N-[(4-ethylmorpholin-2-yl)methyl]benzamide
CID 114398949
3-amino-N-[(4-ethylmorpholin-2-yl)methyl]-1H-pyrazole-5-carboxamide
CID 114399014
2-amino-N-(1,4-dioxan-2-ylmethyl)-6-ethoxybenzamide
CID 81420849
3-(chloromethyl)-N-[(4-ethylmorpholin-2-yl)methyl]benzamide
CID 114399696
N-[[(2R)-4-[(2,3-dimethoxyphenyl)methyl]morpholin-2-yl]methyl]acetamide
CID 124614604
2-amino-6-methoxy-N-[(1-methylpiperidin-2-yl)methyl]benzamide
CID 81420315
N-[(4-ethylmorpholin-2-yl)methyl]-2-methoxyacetamide
CID 115629823
N-[(4-ethylmorpholin-2-yl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 115631010
N-[(4-ethylmorpholin-2-yl)methyl]-5-(methylamino)pyridine-2-carboxamide
CID 114401189

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide?
The IUPAC name of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide (CID 114399024) is 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide.
What is the SMILES notation for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide?
The canonical SMILES for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide is CCN1CCOC(CNC(=O)c2c(N)cccc2OC)C1.
What is the InChIKey of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide?
The InChIKey is ZKRZVNFTCGBWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-3-18-7-8-21-11(10-18)9-17-15(19)14-12(16)5-4-6-13(14)20-2/h4-6,11H,3,7-10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide?
2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide has a molecular weight of 293.37 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]-6-methoxybenzamide is sourced from PubChem (CID 114399024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).