N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide

C21H25N3O4 — CID 18078727

IUPACN-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide
SMILESCCN(CC(=O)Nc1cccc(C(C)=O)c1)CC(=O)Nc1ccccc1OC
InChIInChI=1S/C21H25N3O4/c1-4-24(14-21(27)23-18-10-5-6-11-19(18)28-3)13-20(26)22-17-9-7-8-16(12-17)15(2)25/h5-12H,4,13-14H2,1-3H3,(H,22,26)(H,23,27)
InChIKeyNDIHVIINIRUIFJ-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.80
Rot. Bonds9

About N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide

N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide (PubChem CID 18078727) has the molecular formula C21H25N3O4 and a molecular weight of 383.45 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide
PubChem CID18078727
Molecular FormulaC21H25N3O4
Molecular Weight383.45 g/mol
Exact Mass383.18
IUPAC NameN-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide
SMILESCCN(CC(=O)Nc1cccc(C(C)=O)c1)CC(=O)Nc1ccccc1OC
InChIInChI=1S/C21H25N3O4/c1-4-24(14-21(27)23-18-10-5-6-11-19(18)28-3)13-20(26)22-17-9-7-8-16(12-17)15(2)25/h5-12H,4,13-14H2,1-3H3,(H,22,26)(H,23,27)
InChIKeyNDIHVIINIRUIFJ-UHFFFAOYSA-N
XLogP2.80
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-[[2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetyl]amino]benzamide
CID 18287366
N-(4-acetamidophenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide
CID 9029924
2-[[2-(3-acetylanilino)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 9432878
N-(3-chloro-4-fluorophenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide
CID 9029512
N-(3-carbamoylphenyl)-N'-(2-methoxyphenyl)propanediamide
CID 50875903
2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-ethylamino]-N-(2-methoxyphenyl)acetamide
CID 9029907
propan-2-yl 4-[[2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetyl]amino]benzoate
CID 9029476
2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)acetamide
CID 4882753
N-(3-acetylphenyl)-2-(2-methoxyphenyl)acetamide
CID 2711452
N-(3-acetylphenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78962325
2-[ethyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 9030983
2-[[2-(3-bromoanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxyphenyl)acetamide
CID 9026006

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide (CID 18078727) is N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide is CCN(CC(=O)Nc1cccc(C(C)=O)c1)CC(=O)Nc1ccccc1OC.
What is the InChIKey of N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide?
The InChIKey is NDIHVIINIRUIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4/c1-4-24(14-21(27)23-18-10-5-6-11-19(18)28-3)13-20(26)22-17-9-7-8-16(12-17)15(2)25/h5-12H,4,13-14H2,1-3H3,(H,22,26)(H,23,27).
What are the key properties of N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide?
N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide has a molecular weight of 383.45 g/mol, XLogP of 2.80, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 18078727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).