N-[2-(2-ethoxyanilino)ethyl]acetamide

C12H18N2O2 — CID 103604124

IUPACN-[2-(2-ethoxyanilino)ethyl]acetamide
SMILESCCOc1ccccc1NCCNC(C)=O
InChIInChI=1S/C12H18N2O2/c1-3-16-12-7-5-4-6-11(12)14-9-8-13-10(2)15/h4-7,14H,3,8-9H2,1-2H3,(H,13,15)
InChIKeyPZLKQFHRJRFIEO-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.63
Rot. Bonds6

About N-[2-(2-ethoxyanilino)ethyl]acetamide

N-[2-(2-ethoxyanilino)ethyl]acetamide (PubChem CID 103604124) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[2-(2-ethoxyanilino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-ethoxyanilino)ethyl]acetamide
PubChem CID103604124
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-[2-(2-ethoxyanilino)ethyl]acetamide
SMILESCCOc1ccccc1NCCNC(C)=O
InChIInChI=1S/C12H18N2O2/c1-3-16-12-7-5-4-6-11(12)14-9-8-13-10(2)15/h4-7,14H,3,8-9H2,1-2H3,(H,13,15)
InChIKeyPZLKQFHRJRFIEO-UHFFFAOYSA-N
XLogP1.63
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-phenoxyanilino)ethyl]acetamide
CID 103604146
3-(2-ethoxyanilino)propanamide
CID 43131857
2-ethoxy-N-(2-fluoroethyl)aniline
CID 80699443
4-(2-ethoxyanilino)-2-methylbutan-2-ol
CID 79359575
2-(2-amino-3-ethoxyanilino)ethylurea
CID 113392780
N-[2-(2-propylanilino)ethyl]acetamide
CID 107529290
2-ethoxy-N-nonylaniline
CID 43129179
3-(2-ethoxyanilino)propanenitrile
CID 7100
N'-(2-ethoxyphenyl)-N-heptylethane-1,2-diamine
CID 54807395
3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109039806
N-[2-[2-(2-methoxyethyl)anilino]ethyl]acetamide
CID 107530128
1-(2-ethoxyphenyl)-3-(2-methoxyethyl)urea
CID 47032357

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethoxyanilino)ethyl]acetamide?
The IUPAC name of N-[2-(2-ethoxyanilino)ethyl]acetamide (CID 103604124) is N-[2-(2-ethoxyanilino)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-ethoxyanilino)ethyl]acetamide?
The canonical SMILES for N-[2-(2-ethoxyanilino)ethyl]acetamide is CCOc1ccccc1NCCNC(C)=O.
What is the InChIKey of N-[2-(2-ethoxyanilino)ethyl]acetamide?
The InChIKey is PZLKQFHRJRFIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-16-12-7-5-4-6-11(12)14-9-8-13-10(2)15/h4-7,14H,3,8-9H2,1-2H3,(H,13,15).
What are the key properties of N-[2-(2-ethoxyanilino)ethyl]acetamide?
N-[2-(2-ethoxyanilino)ethyl]acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethoxyanilino)ethyl]acetamide is sourced from PubChem (CID 103604124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).