2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide

C17H20N2O3 — CID 154973812

IUPAC2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide
SMILESCCNC(=O)c1ccc(OCc2ccccc2)c(OC)c1N
InChIInChI=1S/C17H20N2O3/c1-3-19-17(20)13-9-10-14(16(21-2)15(13)18)22-11-12-7-5-4-6-8-12/h4-10H,3,11,18H2,1-2H3,(H,19,20)
InChIKeyPAHRWLQGIVYAFY-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.61
Rot. Bonds6

About 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide

2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide (PubChem CID 154973812) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound Name2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide
PubChem CID154973812
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide
SMILESCCNC(=O)c1ccc(OCc2ccccc2)c(OC)c1N
InChIInChI=1S/C17H20N2O3/c1-3-19-17(20)13-9-10-14(16(21-2)15(13)18)22-11-12-7-5-4-6-8-12/h4-10H,3,11,18H2,1-2H3,(H,19,20)
InChIKeyPAHRWLQGIVYAFY-UHFFFAOYSA-N
XLogP2.61
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-cyclopropyl-3-methoxy-4-phenylmethoxybenzamide
CID 162701297
2-amino-3-methoxy-4-phenylmethoxybenzaldehyde
CID 137428196
methyl 6-acetyl-2-methoxy-3-phenylmethoxybenzoate
CID 91864043
N-(4-amino-4-methylpentyl)-2-fluoro-3,4-bis(phenylmethoxy)benzamide
CID 142494026
dimethyl (E)-2,3-bis(2-phenylmethoxyphenyl)but-2-enedioate
CID 135020990
methyl 3-hydroxy-2-methyl-4-phenylmethoxybenzoate
CID 141491385
3-N,4-N-bis(2-ethyl-3-methoxy-4-phenylmethoxyphenyl)furan-3,4-dicarboxamide
CID 139807096
N-[2-[(2-fluorobenzoyl)amino]ethyl]-3-methoxy-4-phenylmethoxybenzamide
CID 55975456
ethyl 2-[(5-amino-2-phenylmethoxybenzoyl)amino]acetate;hydrochloride
CID 24838474
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
CID 8750850
1-(3,4-dimethoxy-5-phenylmethoxyphenyl)-3-(2-hydroxy-3,4-dimethoxyphenyl)propane-1,3-dione
CID 24750378
ethyl 3-[4-methoxy-3,5-bis(phenylmethoxy)phenyl]-3-oxopropanoate
CID 10741488

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide?
The IUPAC name of 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide (CID 154973812) is 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide?
The canonical SMILES for 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide is CCNC(=O)c1ccc(OCc2ccccc2)c(OC)c1N.
What is the InChIKey of 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide?
The InChIKey is PAHRWLQGIVYAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-3-19-17(20)13-9-10-14(16(21-2)15(13)18)22-11-12-7-5-4-6-8-12/h4-10H,3,11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide?
2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide has a molecular weight of 300.36 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-3-methoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 154973812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).