N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide

C19H23N3O3 — CID 119679545

IUPACN-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
SMILESCOCCNCC(=O)Nc1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C19H23N3O3/c1-25-12-11-20-14-18(23)22-17-10-6-5-9-16(17)19(24)21-13-15-7-3-2-4-8-15/h2-10,20H,11-14H2,1H3,(H,21,24)(H,22,23)
InChIKeyREXJZANXSITYAY-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.79
Rot. Bonds9

About N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide

N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide (PubChem CID 119679545) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
PubChem CID119679545
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
SMILESCOCCNCC(=O)Nc1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C19H23N3O3/c1-25-12-11-20-14-18(23)22-17-10-6-5-9-16(17)19(24)21-13-15-7-3-2-4-8-15/h2-10,20H,11-14H2,1H3,(H,21,24)(H,22,23)
InChIKeyREXJZANXSITYAY-UHFFFAOYSA-N
XLogP1.79
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide;hydrochloride
CID 119679544
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride
CID 119676959
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-methylpropyl)benzamide;hydrochloride
CID 119684657
N,N-diethyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide;hydrochloride
CID 119746610
N-(2-methoxyethyl)-2-(3-phenylpropanoylamino)benzamide
CID 2206654
N-benzyl-2-[[2-(2,5-dimethylphenyl)acetyl]amino]benzamide
CID 92646177
2-(benzylamino)-N-(2-methoxyethyl)acetamide
CID 54813572
N-benzyl-2-[[2-(2-methoxyphenyl)sulfanylacetyl]amino]benzamide
CID 52772307
methyl 3-[[2-[2-(benzylcarbamoyl)anilino]-2-oxoethyl]amino]benzoate
CID 47013640
[2-[2-(benzylcarbamoyl)anilino]-2-oxoethyl] propanoate
CID 9015181
2-(2-methoxyethylamino)-N-(4-methyl-2-phenylmethoxyphenyl)acetamide
CID 119726802
N-benzyl-2-(heptanoylamino)benzamide
CID 54789241

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide?
The IUPAC name of N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide (CID 119679545) is N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide.
What is the SMILES notation for N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide?
The canonical SMILES for N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide is COCCNCC(=O)Nc1ccccc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide?
The InChIKey is REXJZANXSITYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-25-12-11-20-14-18(23)22-17-10-6-5-9-16(17)19(24)21-13-15-7-3-2-4-8-15/h2-10,20H,11-14H2,1H3,(H,21,24)(H,22,23).
What are the key properties of N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide?
N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide has a molecular weight of 341.41 g/mol, XLogP of 1.79, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[[2-(2-methoxyethylamino)acetyl]amino]benzamide is sourced from PubChem (CID 119679545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).